FULL DB

Total number of items: 1633432
Total number of pages: 1634 ( 1000 items on each page )

STK534843
Synonyms: N-benzyl-2-cyano-2-[3-(pyrrolidin-1-yl)quinoxalin-2-yl]acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCCC1)C(=O)NCc1ccccc1

STK534844
Synonyms: (5Z)-5-{3-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-4-methoxybenzylidene}-1-[2-(4-fluorophenyl)ethyl]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)CCc1ccc(cc1)F

STK534845
Synonyms: 2-amino-N-(2-methylpropyl)-1-(naphthalen-2-yl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CC(CNC(=O)c1c2nc3ccccc3nc2n(c1N)c1ccc2c(c1)cccc2)C

STK534846
Synonyms: 6-nitro-1H-benzotriazol-1-ol
Smiles: [O-][N+](=O)c1ccc2c(c1)n(O)nn2

STK534847
Synonyms: 2-amino-N-hexyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCCCNC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1)C(F)(F)F

STK534848
Synonyms: 4-[3-(4-methoxyphenyl)-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: COc1ccc(cc1)C1=NN(C(C1)c1ccccc1)C(=O)CCC(=O)O

STK534849
Synonyms: N-ethyl-N-(2-hydroxyethyl)-3-[(5Z)-5-(4-methylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanamide
Smiles: OCCN(C(=O)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O)CC

STK534850
Synonyms: (5E)-5-(2,6-dichlorobenzylidene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2c(Cl)cccc2Cl)/C1=O

STK534851
Synonyms: 1-[5-(2-methoxyphenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]propan-1-one
Smiles: CCC(=O)N1N=C(CC1c1ccccc1OC)c1ccc(cc1)C

STK534853
Synonyms: (2Z)-5-bromo-4-chloro-2-{[(2-fluorophenyl)amino]methylidene}-1,2-dihydro-3H-indol-3-one
Smiles: Fc1ccccc1N/C=C/1\Nc2c(C1=O)c(Cl)c(cc2)Br

STK534854
Synonyms: N,N'-(sulfonyldibenzene-4,1-diyl)bis{2-[4-(2-methylpropyl)phenyl]propanamide}
Smiles: CC(c1ccc(cc1)CC(C)C)C(=O)Nc1ccc(cc1)S(=O)(=O)c1ccc(cc1)NC(=O)C(c1ccc(cc1)CC(C)C)C

STK534855
Synonyms: 2-amino-1-(1,3-benzodioxol-5-ylmethyl)-N-(4-methylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1ccc(cc1)NC(=O)c1c2nc3ccccc3nc2n(c1N)Cc1ccc2c(c1)OCO2

STK534856
Synonyms: 11-(4-ethoxyphenyl)-3-(3-methoxypropyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: COCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(cc1)OCC

STK534857
Synonyms: 2-amino-1-(3,4-dimethoxyphenyl)-N-[2-(morpholin-4-yl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1cc(ccc1OC)n1c(N)c(c2c1nc1ccccc1n2)C(=O)NCCN1CCOCC1

STK534860
Synonyms: 2',6,6'-trichloro-4,4'-diphenyl-2,3'-biquinoline
Smiles: Clc1ccc2c(c1)c(cc(n2)c1c(Cl)nc2c(c1c1ccccc1)cc(cc2)Cl)c1ccccc1

STK534861
Synonyms: (5Z)-5-(1H-indol-3-ylmethylidene)-1-(4-methoxybenzyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1)CN1C(=O)NC(=O)/C(=C/c2c[nH]c3c2cccc3)/C1=O

STK534862
Synonyms: 4-{5-[4-(dimethylamino)phenyl]-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl}-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccc(cc1)N(C)C)c1cccs1

STK534863
Synonyms: ethyl4-(4-{(1E)-1-[2-(methylcarbamothioyl)hydrazinylidene]ethyl}phenyl)butanoate
Smiles: CCOC(=O)CCCc1ccc(cc1)/C(=N/NC(=S)NC)/C

STK534864
Synonyms: 2-(4-fluorophenyl)-1-(4-methylphenyl)-1H-imidazo[4,5-b]quinoxaline
Smiles: Cc1ccc(cc1)n1c(nc2c1nc1ccccc1n2)c1ccc(cc1)F

STK534865
Synonyms: 2-(naphthalen-1-yl)-5-(3-nitrophenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: [O-][N+](=O)c1cccc(c1)C1Oc2ccccc2C2N1N=C(C2)c1cccc2c1cccc2

STK534866
Synonyms: 5-(4-tert-butylphenyl)-9-methoxy-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: COc1ccc2c(c1)C1CC(=NN1C(O2)c1ccc(cc1)C(C)(C)C)c1ccccc1

STK534869
Synonyms: 4-[3-(4-bromophenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: COc1cc(ccc1OC)C1CC(=NN1C(=O)CCC(=O)O)c1ccc(cc1)Br

STK534871
Synonyms: 2-amino-1-benzyl-N-[2-(4-fluorophenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Fc1ccc(cc1)CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccccc1

STK534872
Synonyms: 8-hydroxy-7-[(6-hydroxy-8-oxo-3,4-dihydro-2H,8H-pyrimido[2,1-b][1,3]thiazin-7-yl)(3-nitrophenyl)methyl]-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazin-6-one
Smiles: O=c1nc2SCCCn2c(c1C(c1c(O)nc2n(c1=O)CCCS2)c1cccc(c1)[N+](=O)[O-])O

STK534873
Synonyms: 4-(2-chlorophenyl)-2-oxo-1,3-benzoxathiol-5-yl3-[(5E)-5-(4-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoate
Smiles: O=C(Oc1ccc2c(c1c1ccccc1Cl)sc(=O)o2)CCN1C(=S)S/C(=C/c2ccc(cc2)F)/C1=O

STK534875
Synonyms: prop-2-en-1-yl(2E)-2-(4-fluorobenzylidene)-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C\c1ccc(cc1)F)/s2

STK534876
Synonyms: 1-hydroxy-1-{1-(2-methoxybenzyl)-5,5-dimethyl-2-oxo-3-[3-(trifluoromethyl)phenyl]imidazolidin-4-yl}-3-[3-(trifluoromethyl)phenyl]urea
Smiles: COc1ccccc1CN1C(=O)N(C(C1(C)C)N(C(=O)Nc1cccc(c1)C(F)(F)F)O)c1cccc(c1)C(F)(F)F

STK534877
Synonyms: (5Z)-1-(2,5-dimethoxyphenyl)-5-[(piperidin-1-ylamino)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1N1C(=O)NC(=O)/C(=C/NN2CCCCC2)/C1=O)OC

STK534878
Synonyms: prop-2-en-1-yl(2Z)-5-(3,4-dimethoxyphenyl)-7-methyl-2-[(5-methylfuran-2-yl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C/c1ccc(o1)C)/s2

STK534879
Synonyms: (9E)-9-(4-chlorobenzylidene)-5-(4-chlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Smiles: Clc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc3c(c1)OCCO3)/C(=C/c1ccc(cc1)Cl)/CCC2

STK534880
Synonyms: ethyl4-chloro-6-[(dimethylamino)methyl]-5-hydroxy-2-methyl-1-benzofuran-3-carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1c(Cl)c(c(c2)CN(C)C)O

STK534881
Synonyms: N'-[(Z)-(2-chlorophenyl)methylidene]-2-[4-(6-chloro-4-phenylquinolin-2-yl)phenoxy]acetohydrazide
Smiles: O=C(COc1ccc(cc1)c1nc2ccc(cc2c(c1)c1ccccc1)Cl)N/N=C\c1ccccc1Cl

STK534882
Synonyms: 2-amino-N-cyclohexyl-1-(3-methylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1cccc(c1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)NC1CCCCC1

STK534883
Synonyms: 2-amino-N-(2-methoxybenzyl)-1-(naphthalen-2-yl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1ccccc1CNC(=O)c1c2nc3ccccc3nc2n(c1N)c1ccc2c(c1)cccc2

STK534885
Synonyms: (diphenylphosphoryl)methylcarbamimidothioate
Smiles: NC(=N)SCP(=O)(c1ccccc1)c1ccccc1

STK534886
Synonyms: ethyl2-amino-1-[2-(2-methoxyphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCOC(=O)c1c2nc3ccccc3nc2n(c1N)CCc1ccccc1OC

STK534888
Synonyms: 2-amino-1-(4-methylphenyl)-N-(tetrahydrofuran-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1ccc(cc1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)NCC1CCCO1

STK534889
Synonyms: prop-2-en-1-yl(2E)-5-(4-methoxyphenyl)-7-methyl-2-(3-nitrobenzylidene)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C\c1cccc(c1)[N+](=O)[O-])/s2

STK534890
Synonyms: 2-amino-1-benzyl-N-(3,4-dimethylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: O=C(c1c(N)n(c2c1nc1ccccc1n2)Cc1ccccc1)Nc1ccc(c(c1)C)C

STK534893
Synonyms: methylN-[{5-bromo-2-[(3-chloropropanoyl)amino]phenyl}(2-chlorophenyl)methyl]glycinate
Smiles: ClCCC(=O)Nc1ccc(cc1C(c1ccccc1Cl)NCC(=O)OC)Br

STK534895
Synonyms: ethyl1-(3-{1-cyano-2-oxo-2-[(2-phenylethyl)amino]ethyl}quinoxalin-2-yl)piperidine-3-carboxylate
Smiles: CCOC(=O)C1CCCN(C1)c1nc2ccccc2nc1C(C(=O)NCCc1ccccc1)C#N

STK534896
Synonyms: (5Z)-1-(4-chlorophenyl)-5-({[2-(diethylamino)ethyl]amino}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCN(CCN/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)Cl)CC

STK534897
Synonyms: 3-butyl-11-(3,4-dimethylphenyl)-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCCCn1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)C)C

STK534898
Synonyms: 2-amino-1-(4-butoxyphenyl)-N-(naphthalen-1-yl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCOc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)Nc1cccc2c1cccc2

STK534899
Synonyms: prop-2-en-1-yl(2Z)-5-(3,4-dimethoxyphenyl)-7-methyl-2-(3-nitrobenzylidene)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C/c1cccc(c1)[N+](=O)[O-])/s2

STK534900
Synonyms: dimethyl4,4'-{[(4aR,8aS)-2,3-dioxooctahydroquinoxaline-1,4-diyl]bis(oxymethanediyl)}dibenzoate
Smiles: COC(=O)c1ccc(cc1)CON1[C@@H]2CCCC[C@@H]2N(C(=O)C1=O)OCc1ccc(cc1)C(=O)OC

STK534901
Synonyms: 2-amino-1-(3-chlorophenyl)-N-(4-methylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1ccc(cc1)NC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1)Cl

STK534903
Synonyms: 2-{1-(4-methoxybenzyl)-5,5-dimethyl-2-oxo-3-[3-(trifluoromethyl)phenyl]imidazolidin-4-yl}-4-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazolidine-3,5-dione
Smiles: COc1ccc(cc1)CN1C(=O)N(C(C1(C)C)n1oc(=O)n(c1=O)c1cccc(c1)C(F)(F)F)c1cccc(c1)C(F)(F)F

STK534904
Synonyms: N-[(4Z)-1-(2-methoxyphenyl)-2-(methylsulfanyl)-1,3-diazaspiro[4.5]dec-2-en-4-ylidene]-2,6-dimethylaniline
Smiles: CSC1=N/C(=N\c2c(C)cccc2C)/C2(N1c1ccccc1OC)CCCCC2

STK534905
Synonyms: 3-(4-chlorophenyl)-1-[3-(4-chlorophenyl)-1-{4-[(2Z)-2-(3,5-dichlorobenzylidene)hydrazinyl]-4-oxobutyl}-5,5-dimethyl-2-oxoimidazolidin-4-yl]-1-hydroxyurea
Smiles: O=C(N/N=C\c1cc(Cl)cc(c1)Cl)CCCN1C(=O)N(C(C1(C)C)N(C(=O)Nc1ccc(cc1)Cl)O)c1ccc(cc1)Cl

STK534906
Synonyms: 2-amino-1-[4-(octyloxy)phenyl]-N-(2-phenylethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCCCCCOc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)NCCc1ccccc1

STK534907
Synonyms: 2-amino-N-benzyl-1-(2-phenylethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: O=C(c1c(N)n(c2c1nc1ccccc1n2)CCc1ccccc1)NCc1ccccc1

STK534908
Synonyms: prop-2-en-1-yl(2Z)-5-(4-methoxyphenyl)-7-methyl-3-oxo-2-(2-oxo-1-propyl-1,2-dihydro-3H-indol-3-ylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCCN1c2ccccc2/C(=c\2/sc3=NC(=C(C(n3c2=O)c2ccc(cc2)OC)C(=O)OCC=C)C)/C1=O

STK534909
Synonyms: 2-amino-1-(4-methoxybenzyl)-N-(tetrahydrofuran-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1ccc(cc1)Cn1c2nc3ccccc3nc2c(c1N)C(=O)NCC1CCCO1

STK534910
Synonyms: N-butyl-2-cyano-2-[3-(4-phenylpiperazin-1-yl)quinoxalin-2-yl]acetamide
Smiles: CCCCNC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)c1ccccc1)C#N

STK534911
Synonyms: 4-{(2E)-2-[1,3-benzothiazol-2-yl(cyano)methylidene]hydrazinyl}benzenesulfonamide
Smiles: N#C/C(=N\Nc1ccc(cc1)S(=O)(=O)N)/c1nc2c(s1)cccc2

STK534912
Synonyms: 5-({[4-(diethylamino)phenyl]amino}methylidene)-1,3-bis(2-methylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCN(c1ccc(cc1)N/C=C/1\C(=O)N(c2ccccc2C)C(=S)N(C1=O)c1ccccc1C)CC

STK534913
Synonyms: 2-amino-1-(furan-2-ylmethyl)-N-(3-methoxypropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccco1

STK534914
Synonyms: methylN-[(5-chloro-2-{[(3,4,5-trimethoxyphenyl)carbonyl]amino}phenyl)(phenyl)methyl]glycinate
Smiles: COC(=O)CNC(c1cc(Cl)ccc1NC(=O)c1cc(OC)c(c(c1)OC)OC)c1ccccc1

STK534915
Synonyms: N-{2-[2-amino-3-(phenylsulfonyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl]ethyl}-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)NCCn1c2nc3ccccc3nc2c(c1N)S(=O)(=O)c1ccccc1

STK534916
Synonyms: 2-amino-1-[2-(cyclohex-1-en-1-yl)ethyl]-N-(2-phenylethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: O=C(c1c(N)n(c2c1nc1ccccc1n2)CCC1=CCCCC1)NCCc1ccccc1

STK534919
Synonyms: 5-(2,4-dichlorophenyl)-9-methoxy-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: COc1ccc2c(c1)C1CC(=NN1C(O2)c1ccc(cc1Cl)Cl)c1ccccc1

STK534920
Synonyms: N-benzyl-N-tert-butyl-4-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanamide
Smiles: S=C1S/C(=C\c2ccccc2Cl)/C(=O)N1CCCC(=O)N(C(C)(C)C)Cc1ccccc1

STK534921
Synonyms: 4,5-bis(4-iodophenyl)-2-[4-(phenylethynyl)phenyl]-1H-imidazole
Smiles: Ic1ccc(cc1)c1[nH]c(nc1c1ccc(cc1)I)c1ccc(cc1)C#Cc1ccccc1

STK534922
Synonyms: 2-amino-N-butyl-1-(2-phenylethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccccc1

STK534923
Synonyms: 4-[3-(4-bromophenyl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: COc1ccc(cc1)C1CC(=NN1C(=O)CCC(=O)O)c1ccc(cc1)Br

STK534924
Synonyms: N,N'-dicyclohexyl-9-(dicyanomethylidene)-9H-fluorene-2,7-disulfonamide
Smiles: N#CC(=C1c2cc(ccc2c2c1cc(cc2)S(=O)(=O)NC1CCCCC1)S(=O)(=O)NC1CCCCC1)C#N

STK534925
Synonyms: 2-[5-(4-bromophenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-phenylquinazoline
Smiles: Brc1ccc(cc1)C1CC(=NN1c1nc2ccccc2c(n1)c1ccccc1)c1ccc(cc1)C

STK534928
Synonyms: N-{1-cyclohexyl-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-yl}propanamide
Smiles: CCC(=O)Nc1n(C2CCCCC2)c2c(c1S(=O)(=O)c1ccc(cc1)C)nc1c(n2)cccc1

STK534929
Synonyms: 2-amino-1-(3,4-dimethylphenyl)-N-[2-(morpholin-4-yl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: O=C(c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)C)C)NCCN1CCOCC1

STK534930
Synonyms: ethyl2-amino-1-[4-(4-aminophenoxy)phenyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)Oc1ccc(cc1)N

STK534934
Synonyms: ethyl1-benzyl-2-{[(2E)-3-phenylprop-2-enoyl]amino}-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)/C=C/c2ccccc2)n(c2c1nc1ccccc1n2)Cc1ccccc1

STK534935
Synonyms: 2-(4-fluorophenyl)-1-(3-methylphenyl)-1H-imidazo[4,5-b]quinoxaline
Smiles: Fc1ccc(cc1)c1nc2c(n1c1cccc(c1)C)nc1c(n2)cccc1

STK534937
Synonyms: N-[4-({3-[(2,3-dimethylphenyl)amino]quinoxalin-2-yl}sulfamoyl)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nc2ccccc2nc1Nc1cccc(c1C)C

STK534939
Synonyms: 2-amino-1-(2,4-dimethoxyphenyl)-N-[2-(morpholin-4-yl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1cc(OC)ccc1n1c(N)c(c2c1nc1ccccc1n2)C(=O)NCCN1CCOCC1

STK534940
Synonyms: 3,3'-sulfonylbis(N-{(E)-[4-(phenylethynyl)phenyl]methylidene}aniline)
Smiles: O=S(=O)(c1cccc(c1)/N=C/c1ccc(cc1)C#Cc1ccccc1)c1cccc(c1)/N=C/c1ccc(cc1)C#Cc1ccccc1

STK534941
Synonyms: 2-amino-1-(2,5-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile
Smiles: N#Cc1c(N)n(c2c1nc1ccccc1n2)c1cc(OC)ccc1OC

STK534943
Synonyms: (9E)-9-(2-chlorobenzylidene)-5-(2-chlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Smiles: Clc1ccccc1C1C2=C(N=c3n1c(cs3)c1ccc3c(c1)OCCO3)/C(=C/c1ccccc1Cl)/CCC2

STK534944
Synonyms: prop-2-en-1-yl(2E)-5-(3,4-dimethoxyphenyl)-2-[4-(dimethylamino)benzylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C\c1ccc(cc1)N(C)C)/s2

STK534945
Synonyms: (4Z)-4-[(2,6-dimethylphenyl)imino]-1-(2-methoxyphenyl)-1,3-diazaspiro[4.5]decane-2-thione
Smiles: COc1ccccc1N1C(=S)N/C(=N\c2c(C)cccc2C)/C21CCCCC2

STK534947
Synonyms: N-[4-({5-[(Z)-(1-cyclohexyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-2-methoxybenzyl}oxy)phenyl]acetamide
Smiles: COc1ccc(cc1COc1ccc(cc1)NC(=O)C)/C=C\1/C(=O)NC(=S)N(C1=O)C1CCCCC1

STK534948
Synonyms: 2-cyano-2-{3-[4-(4-fluorophenyl)piperazin-1-yl]quinoxalin-2-yl}-N-(2-methoxyethyl)acetamide
Smiles: COCCNC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)c1ccc(cc1)F)C#N

STK534949
Synonyms: 5-ethyl-6-hydroxy-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-phenylpyrimidin-4(3H)-one
Smiles: CCc1c(O)nc(n(c1=O)c1ccccc1)SCC(=O)c1ccccc1

STK534951
Synonyms: 2-{[4-hydroxy-1-(4-methoxyphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2OC)nc(cc1=O)O

STK534952
Synonyms: 3-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(4-iodophenyl)propanamide
Smiles: O=C(Nc1ccc(cc1)I)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK534953
Synonyms: ethyl2-amino-1-(4-iodophenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)I

STK534954
Synonyms: 2-cyano-N-(4-methoxybenzyl)-2-[3-(piperidin-1-yl)quinoxalin-2-yl]acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCCCC1)C(=O)NCc1ccc(cc1)OC

STK534955
Synonyms: (2Z)-5-bromo-4-chloro-2-({[2-(2,4-dichlorophenyl)ethyl]amino}methylidene)-1,2-dihydro-3H-indol-3-one
Smiles: Clc1ccc(c(c1)Cl)CCN/C=C/1\Nc2c(C1=O)c(Cl)c(cc2)Br

STK534956
Synonyms: ethyl4-carbamoyl-3-(cyclopentylideneamino)-5-methylthiophene-2-carboxylate
Smiles: CCOC(=O)c1sc(c(c1N=C1CCCC1)C(=O)N)C

STK534957
Synonyms: (5Z)-2-[(2,3-dichlorophenyl)amino]-5-(4-fluorobenzylidene)-1,3-thiazol-4(5H)-one
Smiles: Fc1ccc(cc1)/C=C/1\SC(=NC1=O)Nc1cccc(c1Cl)Cl

STK534959
Synonyms: (4-chlorophenyl)(2-{[4-(4-chlorophenyl)-3-methylquinolin-2-yl]amino}phenyl)methanone
Smiles: Clc1ccc(cc1)C(=O)c1ccccc1Nc1nc2ccccc2c(c1C)c1ccc(cc1)Cl

STK534961
Synonyms: 1,3-dimethyl-5-({[2-(piperidin-1-yl)ethyl]amino}methylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CN1C(=S)N(C)C(=O)C(=CNCCN2CCCCC2)C1=O

STK534962
Synonyms: (5Z)-1-(3-chlorophenyl)-5-[(1-methyl-1H-indol-3-yl)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Clc1cccc(c1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)C)/C1=O

STK534963
Synonyms: N-butyl-2-cyano-2-{3-[4-(diphenylmethyl)piperazin-1-yl]quinoxalin-2-yl}acetamide
Smiles: CCCCNC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)C(c1ccccc1)c1ccccc1)C#N

STK534964
Synonyms: 2,2',3,3'-tetraphenyl-6,6'-biquinoxaline
Smiles: c1ccc(cc1)c1nc2cc(ccc2nc1c1ccccc1)c1ccc2c(c1)nc(c(n2)c1ccccc1)c1ccccc1

STK534965
Synonyms: 2-amino-1-(3-chlorophenyl)-N-(3,5-dimethoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1cc(CNC(=O)c2c3nc4ccccc4nc3n(c2N)c2cccc(c2)Cl)cc(c1)OC

STK534966
Synonyms: methyl(2E)-5-(3,4-dimethoxyphenyl)-7-methyl-2-(4-methylbenzylidene)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: COC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C\c1ccc(cc1)C)/s2

STK534967
Synonyms: 4-[3-(6-chloro-2-methyl-4-phenylquinolin-3-yl)-5-(2,4-dichlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccc(cc1Cl)Cl)c1c(C)nc2c(c1c1ccccc1)cc(cc2)Cl

STK534969
Synonyms: 3-(1-methyl-1H-benzimidazol-2-yl)-2-oxo-2H-chromen-7-ylfuran-2-carboxylate
Smiles: O=C(c1ccco1)Oc1ccc2c(c1)oc(=O)c(c2)c1nc2c(n1C)cccc2

STK534970
Synonyms: 2-amino-N-benzyl-1-(2-methylpropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CC(Cn1c(N)c(c2c1nc1ccccc1n2)C(=O)NCc1ccccc1)C

STK534971
Synonyms: 5-(2-chlorophenyl)-9-methoxy-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: COc1ccc2c(c1)C1CC(=NN1C(O2)c1ccccc1Cl)c1ccccc1

STK534972
Synonyms: (5Z)-5-({[4-(diethylamino)phenyl]amino}methylidene)-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCN(c1ccc(cc1)N/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc(c1)C)CC

STK534973
Synonyms: 2-bromo-N-[(2Z)-4-(4-chlorophenyl)-3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1,3-thiazol-2(3H)-ylidene]benzamide
Smiles: Clc1ccc(cc1)c1cs/c(=N\C(=O)c2ccccc2Br)/n1c1c(C)n(n(c1=O)c1ccccc1)C

STK534975
Synonyms: 2-amino-N-(4-methylphenyl)-1-[4-(octyloxy)phenyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCCCCCOc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)Nc1ccc(cc1)C

STK534977
Synonyms: 2-chloro-N-[1-(1-phenylethyl)-3-(phenylsulfonyl)-1H-pyrrolo[2,3-b]quinoxalin-2-yl]benzamide
Smiles: Clc1ccccc1C(=O)Nc1n(C(c2ccccc2)C)c2c(c1S(=O)(=O)c1ccccc1)nc1c(n2)cccc1

STK534979
Synonyms: 2-cyano-2-{3-[4-(diphenylmethyl)piperazin-1-yl]quinoxalin-2-yl}-N-(2-phenylethyl)acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCN(CC1)C(c1ccccc1)c1ccccc1)C(=O)NCCc1ccccc1

STK534980
Synonyms: 4-[(E)-{[4-(6-bromo-4-phenylquinolin-2-yl)phenyl]imino}methyl]-N,N-diethylaniline
Smiles: CCN(c1ccc(cc1)/C=N/c1ccc(cc1)c1nc2ccc(cc2c(c1)c1ccccc1)Br)CC

STK534981
Synonyms: (9E)-9-benzylidene-3-(4-methoxyphenyl)-5-phenyl-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Smiles: COc1ccc(cc1)c1csc2=NC3=C(C(n12)c1ccccc1)CCC/C/3=C\c1ccccc1

STK534983
Synonyms: 1-(9H-carbazol-9-yl)-3-(dipropylamino)propan-2-ol
Smiles: CCCN(CC(Cn1c2ccccc2c2c1cccc2)O)CCC

STK534984
Synonyms: 2-amino-N-(1,3-benzodioxol-5-ylmethyl)-1-(3-chlorophenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Clc1cccc(c1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)NCc1ccc2c(c1)OCO2

STK534989
Synonyms: 5-(dimethylsulfonio)-1-(4-fluorophenyl)-2,4,6-trioxohexahydropyrimidin-5-ide
Smiles: Fc1ccc(cc1)N1C(=O)NC(=O)[C-](C1=O)[S+](C)C

STK534990
Synonyms: N-[4-bromo-2-(phenylcarbonyl)phenyl]-4-methylbenzenesulfonamide
Smiles: Brc1ccc(c(c1)C(=O)c1ccccc1)NS(=O)(=O)c1ccc(cc1)C

STK534992
Synonyms: 4-[4-(biphenyl-4-yl)-5-phenyl-1H-imidazol-2-yl]-N,N-dimethylaniline
Smiles: CN(c1ccc(cc1)c1nc(c([nH]1)c1ccccc1)c1ccc(cc1)c1ccccc1)C

STK534994
Synonyms: 6-bromo-N-(2-methyl-5-nitrophenyl)-4-phenylquinazolin-2-amine
Smiles: Brc1ccc2c(c1)c(nc(n2)Nc1cc(ccc1C)[N+](=O)[O-])c1ccccc1

STK534996
Synonyms: 2-[(2E)-2-(1H-indol-2-ylmethylidene)hydrazinyl]-6-methyl-4-phenylquinazoline
Smiles: Cc1ccc2c(c1)c(nc(n2)N/N=C/c1cc2c([nH]1)cccc2)c1ccccc1

STK534997
Synonyms: 3-bromo-N-{3-[(4-methylphenyl)sulfonyl]-1-(1-phenylethyl)-1H-pyrrolo[2,3-b]quinoxalin-2-yl}benzamide
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c(NC(=O)c2cccc(c2)Br)n(c2c1nc1ccccc1n2)C(c1ccccc1)C

STK534998
Synonyms: 6,6'-[(3-methoxyphenyl)methanediyl]bis(7-hydroxy-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one)
Smiles: COc1cccc(c1)[C@H](c1c(O)nc2n(c1=O)CCS2)c1c(O)nc2n(c1=O)CCS2

STK534999
Synonyms: 2-cyano-N-[2-(4-methoxyphenyl)ethyl]-2-[3-(4-methylpiperazin-1-yl)quinoxalin-2-yl]acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCN(CC1)C)C(=O)NCCc1ccc(cc1)OC

STK535000
Synonyms: 4-chloro-N-[1-(1-phenylethyl)-3-(phenylsulfonyl)-1H-pyrrolo[2,3-b]quinoxalin-2-yl]benzamide
Smiles: Clc1ccc(cc1)C(=O)Nc1n(C(c2ccccc2)C)c2c(c1S(=O)(=O)c1ccccc1)nc1c(n2)cccc1

STK535001
Synonyms: 4-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(3-iodophenyl)butanamide
Smiles: O=C(Nc1cccc(c1)I)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK535002
Synonyms: 5-(4-chlorophenyl)-9-methoxy-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: COc1ccc2c(c1)C1CC(=NN1C(O2)c1ccc(cc1)Cl)c1ccccc1

STK535003
Synonyms: methyl(2E,4E,6E,8E)-2-acetyl-3,9-bis(dimethylamino)nona-2,4,6,8-tetraenoate
Smiles: COC(=O)/C(=C(/N(C)C)\C=C\C=C\C=C\N(C)C)/C(=O)C

STK535004
Synonyms: 2-cyano-N-cyclohexyl-2-{3-[4-(2-ethoxyphenyl)piperazin-1-yl]quinoxalin-2-yl}acetamide
Smiles: CCOc1ccccc1N1CCN(CC1)c1nc2ccccc2nc1C(C(=O)NC1CCCCC1)C#N

STK535006
Synonyms: N'-{(E)-[1-(4-methoxybenzyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}pyridine-4-carbohydrazide
Smiles: COc1ccc(cc1)CN1C(=O)NC(=O)/C(=C\NNC(=O)c2ccncc2)/C1=O

STK535007
Synonyms: methyl(2E)-5-(4-chlorophenyl)-2-(4-fluorobenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)/c(=C\c1ccc(cc1)F)/s2

STK535010
Synonyms: 1-[2-(2-fluorophenyl)ethyl]-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-amine
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccccc1F

STK535011
Synonyms: methyl(2E)-5-(4-chlorophenyl)-2-(1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCN1c2ccccc2/C(=c/2\sc3=NC(=C(C(n3c2=O)c2ccc(cc2)Cl)C(=O)OC)C)/C1=O

STK535012
Synonyms: (5Z)-1-(2,5-dimethoxyphenyl)-5-(2,4,6-trimethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(c(c1)N1C(=O)NC(=O)/C(=C/c2c(OC)cc(cc2OC)OC)/C1=O)OC

STK535013
Synonyms: N-{1-butyl-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-yl}-2-chlorobenzamide
Smiles: CCCCn1c2nc3ccccc3nc2c(c1NC(=O)c1ccccc1Cl)S(=O)(=O)c1ccc(cc1)C

STK535014
Synonyms: 4-[3-(4-bromophenyl)-5-(2,3-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: COc1cccc(c1OC)C1CC(=NN1C(=O)CCC(=O)O)c1ccc(cc1)Br

STK535016
Synonyms: 6-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoicacid
Smiles: OC(=O)CCCCCN1C(=S)S/C(=C\c2ccc3c(c2)OCO3)/C1=O

STK535017
Synonyms: 3-(4-chlorophenyl)-1-[3-(4-chlorophenyl)-1-(2-{(2Z)-2-[1-(3,4-dichlorophenyl)ethylidene]hydrazinyl}-2-oxoethyl)-5,5-dimethyl-2-oxoimidazolidin-4-yl]-1-hydroxyurea
Smiles: O=C(CN1C(=O)N(C(C1(C)C)N(C(=O)Nc1ccc(cc1)Cl)O)c1ccc(cc1)Cl)N/N=C(\c1ccc(c(c1)Cl)Cl)/C

STK535018
Synonyms: methyl4-amino-1-(4-methoxyphenyl)-2-methyl-1H-imidazole-5-carboxylate
Smiles: COc1ccc(cc1)n1c(C)nc(c1C(=O)OC)N

STK535019
Synonyms: 5-(diphenylmethyl)-6-hydroxy-2-(prop-2-en-1-ylsulfanyl)pyrimidin-4(3H)-one
Smiles: C=CCSc1nc(O)c(c(=O)[nH]1)C(c1ccccc1)c1ccccc1

STK535022
Synonyms: 6-hydroxy-7-(prop-2-en-1-yl)-3,4-dihydro-2H,8H-pyrimido[2,1-b][1,3]thiazin-8-one
Smiles: Oc1c(CC=C)c(=O)nc2n1CCCS2

STK535023
Synonyms: methyl[6-bromo-2-(4-chlorophenyl)-4-phenyl-1,4-dihydroquinazolin-3(2H)-yl]acetate
Smiles: COC(=O)CN1C(Nc2c(C1c1ccccc1)cc(cc2)Br)c1ccc(cc1)Cl

STK535024
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-2-[3-(diethylamino)quinoxalin-2-yl]acetamide
Smiles: N#CC(c1nc2ccccc2nc1N(CC)CC)C(=O)NCc1ccc2c(c1)OCO2

STK535025
Synonyms: 2-amino-1-(furan-2-ylmethyl)-N-(2-methoxyethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccco1

STK535026
Synonyms: N-(4-chlorophenyl)-N-[3-(3,6-dichloro-9H-carbazol-9-yl)-2-hydroxypropyl]-4-methylbenzenesulfonamide
Smiles: Clc1ccc(cc1)N(S(=O)(=O)c1ccc(cc1)C)CC(Cn1c2ccc(cc2c2c1ccc(c2)Cl)Cl)O

STK535027
Synonyms: 2-amino-1-(3,4-dimethylphenyl)-N-(tetrahydrofuran-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: O=C(c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)C)C)NCC1CCCO1

STK535028
Synonyms: N-[4-({3-[(3,4-dimethylphenyl)amino]quinoxalin-2-yl}sulfamoyl)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nc2ccccc2nc1Nc1ccc(c(c1)C)C

STK535030
Synonyms: ethyl4-[2-amino-3-(butylcarbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl]benzoate
Smiles: CCCCNC(=O)c1c2nc3ccccc3nc2n(c1N)c1ccc(cc1)C(=O)OCC

STK535032
Synonyms: (5Z)-5-{3-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-4-methoxybenzylidene}-1-(4-methoxybenzyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1)CN1C(=O)NC(=O)/C(=C/c2ccc(c(c2)CN2C(=O)c3c(C2=O)cccc3)OC)/C1=O

STK535033
Synonyms: (5Z,5'Z)-5,5'-{hexane-1,6-diylbis[imino(Z)methylylidene]}bis(1-benzylpyrimidine-2,4,6(1H,3H,5H)-trione)
Smiles: O=C1NC(=O)N(C(=O)/C/1=C\NCCCCCCN/C=C\1/C(=O)NC(=O)N(C1=O)Cc1ccccc1)Cc1ccccc1

STK535034
Synonyms: N-(3,4-dichlorophenyl)-2-({[(2Z)-2-{2-[(3,4-dichlorophenyl)carbamoyl]hydrazinylidene}-3-methyl-2,3-dihydro-1,3-benzothiazol-6-yl]oxy}acetyl)hydrazinecarboxamide
Smiles: O=C(COc1ccc2c(c1)s/c(=N\NC(=O)Nc1ccc(c(c1)Cl)Cl)/n2C)NNC(=O)Nc1ccc(c(c1)Cl)Cl

STK535035
Synonyms: 2-(5-{(Z)-[1-(2-fluorophenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2-methoxybenzyl)-1H-isoindole-1,3(2H)-dione
Smiles: COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=C\1/C(=O)NC(=S)N(C1=O)c1ccccc1F

STK535036
Synonyms: 4,5-bis(4-methylphenyl)-2-[4-(phenylethynyl)phenyl]-1H-imidazole
Smiles: Cc1ccc(cc1)c1[nH]c(nc1c1ccc(cc1)C)c1ccc(cc1)C#Cc1ccccc1

STK535038
Synonyms: 2-amino-1-(3-chlorophenyl)-N-[2-(morpholin-4-yl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Clc1cccc(c1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)NCCN1CCOCC1

STK535040
Synonyms: 2-amino-1-benzyl-N-octyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccccc1

STK535041
Synonyms: pentyl3-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoate
Smiles: CCCCCOC(=O)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK535043
Synonyms: methyl[6-bromo-2-(2-fluorophenyl)-4-phenyl-1,4-dihydroquinazolin-3(2H)-yl]acetate
Smiles: COC(=O)CN1C(c2ccccc2)c2cc(Br)ccc2NC1c1ccccc1F

STK535044
Synonyms: 5-(3-nitrophenyl)-2-(3-phenoxyphenyl)-4-phenyl-1H-imidazole
Smiles: [O-][N+](=O)c1cccc(c1)c1[nH]c(nc1c1ccccc1)c1cccc(c1)Oc1ccccc1

STK535045
Synonyms: [3-(4-bromophenyl)-5-(2-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl](4-methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)N1N=C(CC1c1ccccc1OC)c1ccc(cc1)Br

STK535047
Synonyms: 2-chloro-1-[5-(4-fluorophenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethanone
Smiles: ClCC(=O)N1N=C(CC1c1ccc(cc1)F)c1ccc(cc1)OC

STK535049
Synonyms: ethyl[2,5-dimethyl-4-oxo-7-(phenylcarbamoyl)thieno[3,4-d]pyrimidin-3(4H)-yl]acetate
Smiles: CCOC(=O)Cn1c(C)nc2c(c1=O)c(C)sc2C(=O)Nc1ccccc1

STK535050
Synonyms: 5-(dimethylsulfonio)-1-[2-(4-fluorophenyl)ethyl]-2,4,6-trioxohexahydropyrimidin-5-ide
Smiles: Fc1ccc(cc1)CCN1C(=O)NC(=O)[C-](C1=O)[S+](C)C

STK535051
Synonyms: ethyl(2E)-5-[4-(acetyloxy)-3-ethoxyphenyl]-7-methyl-3-oxo-2-(3-phenoxybenzylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OCC)OC(=O)C)c(=O)/c(=C\c1cccc(c1)Oc1ccccc1)/s2

STK535052
Synonyms: (9E)-3-(4-bromophenyl)-9-(4-fluorobenzylidene)-5-(4-fluorophenyl)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Smiles: Fc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)Br)/C(=C/c1ccc(cc1)F)/CCC2

STK535053
Synonyms: ethyl(2E)-2-{3-bromo-4-[(2-chlorobenzyl)oxy]-5-methoxybenzylidene}-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C\c1cc(Br)c(c(c1)OC)OCc1ccccc1Cl)/s2

STK535054
Synonyms: 4-chloro-N-{3-[(4-methylphenyl)sulfonyl]-1-(2-phenylethyl)-1H-pyrrolo[2,3-b]quinoxalin-2-yl}benzamide
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c(NC(=O)c2ccc(cc2)Cl)n(c2c1nc1ccccc1n2)CCc1ccccc1

STK535055
Synonyms: prop-2-en-1-yl(2E)-5-(4-methoxyphenyl)-7-methyl-2-(4-methylbenzylidene)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C\c1ccc(cc1)C)/s2

STK535057
Synonyms: 2-amino-N-(1,3-benzodioxol-5-ylmethyl)-1-(2-ethylhexyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCC(Cn1c(N)c(c2c1nc1ccccc1n2)C(=O)NCc1ccc2c(c1)OCO2)CC

STK535058
Synonyms: 2-cyano-2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-N-(4-methoxybenzyl)acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CC(C)OC(C1)C)C(=O)NCc1ccc(cc1)OC

STK535059
Synonyms: N-[2-(2-amino-3-cyano-1H-pyrrolo[2,3-b]quinoxalin-1-yl)ethyl]-4-methoxybenzamide
Smiles: N#Cc1c(N)n(c2c1nc1ccccc1n2)CCNC(=O)c1ccc(cc1)OC

STK535060
Synonyms: (5Z)-3-[4-(2-chloro-10H-phenothiazin-10-yl)-4-oxobutyl]-5-(4-methylbenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: Cc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)N1c2ccccc2Sc2c1cc(Cl)cc2

STK535061
Synonyms: 3-(2,3-dihydro-1,4-benzodioxin-6-yloxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl6-{[(4-methylphenyl)sulfonyl]amino}hexanoate
Smiles: O=C(Oc1ccc2c(c1)oc(c(c2=O)Oc1ccc2c(c1)OCCO2)C(F)(F)F)CCCCCNS(=O)(=O)c1ccc(cc1)C

STK535062
Synonyms: (5Z)-5-(2,3-dimethoxybenzylidene)-1-(4-fluorobenzyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1cccc(c1OC)/C=C\1/C(=O)NC(=O)N(C1=O)Cc1ccc(cc1)F

STK535063
Synonyms: (5E)-1-[2-(4-fluorophenyl)ethyl]-5-(3,4,5-trimethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1c(OC)cc(cc1OC)/C=C/1\C(=O)NC(=O)N(C1=O)CCc1ccc(cc1)F

STK535064
Synonyms: 2-[4-(6-chloro-4-phenylquinolin-2-yl)phenoxy]-N'-[(Z)-(2,3-dimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1c(/C=N\NC(=O)COc2ccc(cc2)c2nc3ccc(cc3c(c2)c2ccccc2)Cl)cccc1OC

STK535065
Synonyms: 8-chloro-9-(oxiran-2-ylmethyl)-2,3,4,9-tetrahydro-1H-carbazol-1-one
Smiles: O=C1CCCc2c1n(CC1CO1)c1c2cccc1Cl

STK535066
Synonyms: 2-(4-chlorophenyl)-3-[6-(4-iodophenoxy)hexyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCCOc1ccc(cc1)I

STK535068
Synonyms: 2-(4-chlorophenyl)-3-[4-(4-iodophenoxy)butyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCOc1ccc(cc1)I

STK535069
Synonyms: 4-chloro-3-nitro-N'-[3-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)propanoyl]benzohydrazide
Smiles: O=C(CCn1c2ccccc2c2c1CCCC2)NNC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl

STK535070
Synonyms: 3-[2-(2-chloro-4-methylphenoxy)ethyl]-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccc(cc1Cl)C

STK535071
Synonyms: 4-(biphenyl-4-yloxy)-2-(pyridin-3-yl)quinazoline
Smiles: c1ccc(cc1)c1ccc(cc1)Oc1nc(nc2c1cccc2)c1cccnc1

STK535072
Synonyms: 2-({(E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)benzamide
Smiles: N#C/C(=C\Nc1ccccc1C(=O)N)/c1scc(n1)c1cccc(c1)Br

STK535073
Synonyms: 4-tert-butyl-N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]benzamide
Smiles: O=C(c1ccc(cc1)C(C)(C)C)Nc1cccc(c1C)c1nc2c(o1)cccn2

STK535074
Synonyms: ethylN-acetyl-3,3,3-trifluoro-2-{[3-(trifluoromethyl)phenyl]amino}alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1cccc(c1)C(F)(F)F)NC(=O)C

STK535076
Synonyms: (2E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)OCCO2)/c1scc(n1)c1ccc(c(c1)C)C

STK535077
Synonyms: 4-amino-N-[4-(dimethylamino)phenyl]-2-({2-[(3-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-1,3-thiazole-5-carboxamide
Smiles: O=C(Nc1cccc(c1)[N+](=O)[O-])CSc1nc(c(s1)C(=O)Nc1ccc(cc1)N(C)C)N

STK535078
Synonyms: 3-chloro-N-[3-(2,3-dihydro-1H-inden-5-yloxy)-5-nitrophenyl]-5-(4-fluorophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: Fc1ccc(cc1)C1Nc2c(Cl)c(nn2C(C1)C(F)(F)F)C(=O)Nc1cc(Oc2ccc3c(c2)CCC3)cc(c1)[N+](=O)[O-]

STK535079
Synonyms: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(4-ethoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: CCOc1ccc(cc1)c1cc(C)n2c(n1)cc(n2)C(=O)Nc1sc2c(c1C#N)CCCC2

STK535080
Synonyms: 1-(1H-indol-3-yl)-2-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]ethanone
Smiles: Cc1cccc(c1)N1CCN(CC1C)CC(=O)c1c[nH]c2c1cccc2

STK535081
Synonyms: 2-chloro-6-ethoxy-4-{(Z)-[2-(3-fluorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenylacetate
Smiles: CCOc1cc(/C=C/2\N=C(OC2=O)c2cccc(c2)F)cc(c1OC(=O)C)Cl

STK535082
Synonyms: 5-[(4-methylphenyl)amino]-3-(4-phenylpiperazin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: Cc1ccc(cc1)Nc1cc(N2CCN(CC2)c2ccccc2)c2c3c1C(=O)c1ccccc1c3on2

STK535083
Synonyms: N'~1~,N'~2~-bis(2-butyl-2-hydroxyhexanoyl)-N~1~,N~2~-diphenylbenzene-1,2-dicarbohydrazide
Smiles: CCCCC(C(=O)NN(C(=O)c1ccccc1C(=O)N(c1ccccc1)NC(=O)C(CCCC)(CCCC)O)c1ccccc1)(CCCC)O

STK535084
Synonyms: 3-[6-(2-tert-butylphenoxy)hexyl]-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCCOc1ccccc1C(C)(C)C

STK535085
Synonyms: N-{2-[(3-chloro-2-methylphenyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}-2-ethoxybenzamide
Smiles: CCOc1ccccc1C(=O)NC(C(F)(F)F)(C(F)(F)F)Nc1cccc(c1C)Cl

STK535087
Synonyms: 8-(butan-2-ylidene)-2-(3-chloro-4-methylphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Smiles: CC/C(=C/1\C2C=CC1C1C2C(=O)N(C1=O)c1ccc(c(c1)Cl)C)/C

STK535088
Synonyms: 4-propanoylphenyl2-(4-methoxyphenyl)quinoline-4-carboxylate
Smiles: CCC(=O)c1ccc(cc1)OC(=O)c1cc(nc2c1cccc2)c1ccc(cc1)OC

STK535089
Synonyms: 1-(8-ethoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-phenoxyethanone
Smiles: CCOc1ccc2c(c1)c1c(=S)ssc1C(N2C(=O)COc1ccccc1)(C)C

STK535090
Synonyms: N-(6-fluoro-1,3-benzothiazol-2-yl)-4-hydroxy-2-oxo-1-propyl-1,2-dihydroquinoline-3-carboxamide
Smiles: CCCn1c(=O)c(C(=O)Nc2sc3c(n2)ccc(c3)F)c(c2c1cccc2)O

STK535091
Synonyms: 6-{[4-(diphenylmethyl)piperazin-1-yl]carbonyl}-7-hydroxy-2,3-dihydro-1H,5H-pyrido[3,2,1-ij]quinolin-5-one
Smiles: O=C(c1c(O)c2cccc3c2n(c1=O)CCC3)N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK535092
Synonyms: methyl5-bromo-3-({[(3R)-4-(4-methoxyphenyl)-3-methylpiperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COc1ccc(cc1)N1CCN(CC1C)CC(=O)Nc1c([nH]c2c1cc(Br)cc2)C(=O)OC

STK535093
Synonyms: 3-{5-[(4-chloronaphthalen-1-yl)oxy]pentyl}-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCOc1ccc(c2c1cccc2)Cl

STK535094
Synonyms: 2-hydroxy-2,2-bis(4-methylphenyl)-N'-(pentafluorophenyl)acetohydrazide
Smiles: Cc1ccc(cc1)C(c1ccc(cc1)C)(C(=O)NNc1c(F)c(F)c(c(c1F)F)F)O

STK535095
Synonyms: (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-[(2-oxo-2H-chromen-6-yl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)ccc(=O)o2)/c1scc(n1)c1cccc(c1)Br

STK535097
Synonyms: (2E)-2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-3-(quinolin-6-ylamino)prop-2-enenitrile
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc2c(c1)cccn2)/C#N

STK535098
Synonyms: 2-chloro-N-{[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}benzamide
Smiles: S=C(NC(=O)c1ccccc1Cl)Nc1ccc(c(c1)c1nc2c(o1)cc(cc2)C)Cl

STK535099
Synonyms: (2E)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-(quinolin-6-ylamino)prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)cccn2)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK535100
Synonyms: 4-amino-2-({2-[(4-bromophenyl)amino]-2-oxoethyl}sulfanyl)-N-[4-(dimethylamino)phenyl]-1,3-thiazole-5-carboxamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nc(c(s1)C(=O)Nc1ccc(cc1)N(C)C)N

STK535101
Synonyms: 2-[(2-fluorobenzyl)sulfanyl]-4-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: N#Cc1c(SCc2ccccc2F)nc2c(c1c1ccccc1)CCCC2

STK535102
Synonyms: methyl5-methyl-3-[(2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propanoyl)amino]-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)C)cc(cc2)C

STK535103
Synonyms: 2-(3-nitrophenyl)-2-oxoethyl2-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
Smiles: O=C(c1ccc2c(c1)C(=O)N(C2=O)c1c(C)n(n(c1=O)c1ccccc1)C)OCC(=O)c1cccc(c1)[N+](=O)[O-]

STK535105
Synonyms: 8-[(2E)-2-benzylidenehydrazinyl]-7-(2-chlorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccccc1Cn1c(N/N=C/c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK535106
Synonyms: N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-2-[2-(3,4-dimethoxybenzyl)-1H-benzimidazol-1-yl]acetohydrazide
Smiles: COc1cc(ccc1OC)Cc1nc2c(n1CC(=O)N/N=C/c1c(C)nn(c1Cl)c1ccccc1)cccc2

STK535107
Synonyms: 6-(4-methoxyphenyl)-2-(morpholin-4-yl)pyrimidine-4-carbonitrile
Smiles: N#Cc1nc(nc(c1)c1ccc(cc1)OC)N1CCOCC1

STK535108
Synonyms: (4Z)-2-(4-chloro-3-nitrophenyl)-4-(3-ethoxybenzylidene)-1,3-oxazol-5(4H)-one
Smiles: CCOc1cccc(c1)/C=C/1\N=C(OC1=O)c1ccc(c(c1)[N+](=O)[O-])Cl

STK535109
Synonyms: 2-hydroxy-2,2-bis(2-methoxyphenyl)-N'-methyl-N'-phenylacetohydrazide
Smiles: COc1ccccc1C(c1ccccc1OC)(C(=O)NN(c1ccccc1)C)O

STK535110
Synonyms: 4-(4-methyl-6-{(2E)-2-[4-(pentyloxy)benzylidene]hydrazinyl}pyrimidin-2-yl)morpholine
Smiles: CCCCCOc1ccc(cc1)/C=N/Nc1cc(C)nc(n1)N1CCOCC1

STK535111
Synonyms: 3-amino-N-(3-chlorophenyl)-4-(5-methylfuran-2-yl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
Smiles: Clc1cccc(c1)NC(=O)c1sc2c(c1N)c(c1ccc(o1)C)c1c(n2)CCCC1

STK535112
Synonyms: 1-(4-chlorophenyl)-7,7-dimethyl-3-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}carbonyl)-7,8-dihydroquinoline-2,5(1H,6H)-dione
Smiles: Clc1ccc(cc1)n1c(=O)c(cc2c1CC(C)(C)CC2=O)C(=O)N1CCN(CC1)c1cccc(c1)C(F)(F)F

STK535114
Synonyms: 2-(4-chlorophenyl)-3-[3-(4-ethoxyphenoxy)propyl]quinazolin-4(3H)-one
Smiles: CCOc1ccc(cc1)OCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl

STK535115
Synonyms: 3-bromo-N-(3,4-dichlorophenyl)-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: O=C(c1nn2c(c1Br)NC(CC2C(F)(F)F)c1ccccc1)Nc1ccc(c(c1)Cl)Cl

STK535117
Synonyms: N-benzyl-4-[(2E)-2-(3-chlorobenzylidene)hydrazinyl]-6-methylpyrimidin-2-amine
Smiles: Cc1cc(N/N=C/c2cccc(c2)Cl)nc(n1)NCc1ccccc1

STK535118
Synonyms: (4Z)-2-(2-chlorophenyl)-4-(2-ethoxybenzylidene)-1,3-oxazol-5(4H)-one
Smiles: CCOc1ccccc1/C=C/1\N=C(OC1=O)c1ccccc1Cl

STK535119
Synonyms: 1-[4-(4-ethylphenyl)-3'-(2-methylphenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazol]-5'-yl]ethanone
Smiles: CCc1ccc(cc1)C1=NN(c2ccccc2)C2(c3c1cccc3)SC(=NN2c1ccccc1C)C(=O)C

STK535120
Synonyms: 3-[(2-bromo-4-methylphenyl)amino]-6,7-dimethoxy-2-benzofuran-1(3H)-one
Smiles: COc1c(OC)ccc2c1C(=O)OC2Nc1ccc(cc1Br)C

STK535121
Synonyms: 2-(4-chlorophenyl)-3-{5-[2-methyl-5-(propan-2-yl)phenoxy]pentyl}quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCOc1cc(ccc1C)C(C)C

STK535122
Synonyms: {[2',6'-dinitro-3-(propan-2-yl)-4'H-spiro[cyclohepta[d][1,3]oxazol-3-ium-2,1'-cyclohexa[2,5]dien]-4'-ylidene](oxido)-lambda~5~-azanyl}oxidanide
Smiles: [O-][N+](=C1C=C([N+](=O)[O-])C2(C(=C1)[N+](=O)[O-])OC1=CC=CC=CC1=[N+]2C(C)C)[O-]

STK535123
Synonyms: (2E)-2-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-3-[(2-oxo-2H-chromen-6-yl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)ccc(=O)o2)/c1scc(n1)c1ccc(cc1)CC

STK535124
Synonyms: (2Z)-N-(4-bromophenyl)-2-hydroxy-4-oxo-4-phenylbut-2-enamide
Smiles: Brc1ccc(cc1)NC(=O)/C(=C/C(=O)c1ccccc1)/O

STK535127
Synonyms: 3-[5-(4-chloro-3,5-dimethylphenoxy)pentyl]-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCOc1cc(C)c(c(c1)C)Cl

STK535129
Synonyms: 2-chloro-N'-{hydroxy[bis(3-methylphenyl)]acetyl}-N-phenylpyridine-3-carbohydrazide
Smiles: Cc1cccc(c1)C(C(=O)NN(C(=O)c1cccnc1Cl)c1ccccc1)(c1cccc(c1)C)O

STK535130
Synonyms: propan-2-yl(2E)-3-{3,4-bis[(methoxycarbonyl)oxy]phenyl}prop-2-enoate
Smiles: COC(=O)Oc1cc(/C=C/C(=O)OC(C)C)ccc1OC(=O)OC

STK535131
Synonyms: (2E)-3-[(2-bromo-4-methylphenyl)amino]-2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc(cc1Br)C)/C#N

STK535132
Synonyms: 8-(butan-2-ylidene)-2-(3,5-dichlorophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Smiles: CC/C(=C\1/C2C=CC1C1C2C(=O)N(C1=O)c1cc(Cl)cc(c1)Cl)/C

STK535133
Synonyms: 1,1'-(benzene-1,3-diyldicarbonyl)diazepan-2-one
Smiles: O=C1CCCCCN1C(=O)c1cccc(c1)C(=O)N1CCCCCC1=O

STK535136
Synonyms: methyl2-(2-{2-[2-(4-chlorophenyl)-4-oxoquinazolin-3(4H)-yl]ethoxy}ethoxy)benzoate
Smiles: COC(=O)c1ccccc1OCCOCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl

STK535137
Synonyms: (3-tert-butyl-1-methyl-4-nitro-1H-pyrazol-5-yl)(piperidin-1-yl)methanone
Smiles: O=C(c1n(C)nc(c1[N+](=O)[O-])C(C)(C)C)N1CCCCC1

STK535138
Synonyms: (4R,4aS)-2-amino-4-(3-chlorophenyl)-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile
Smiles: N#CC1=C(N)C([C@H]([C@H]2C1=CCCC2)c1cccc(c1)Cl)(C#N)C#N

STK535139
Synonyms: heptyl(2E)-3-[5-(4-chlorophenyl)furan-2-yl]-2-cyanoprop-2-enoate
Smiles: CCCCCCCOC(=O)/C(=C/c1ccc(o1)c1ccc(cc1)Cl)/C#N

STK535141
Synonyms: (2E)-3-[(4-acetylphenyl)amino]-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)C(=O)C)/c1scc(n1)c1ccc(cc1)F

STK535143
Synonyms: 3-{2-[(2-chloronaphthalen-1-yl)oxy]ethyl}-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1c(Cl)ccc2c1cccc2

STK535144
Synonyms: 1-[3',4-bis(4-bromophenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazol]-5'-yl]ethanone
Smiles: Brc1ccc(cc1)N1N=C(SC21N(N=C(c1c2cccc1)c1ccc(cc1)Br)c1ccccc1)C(=O)C

STK535146
Synonyms: 4-{3-(3-bromophenyl)-5,6-dimethoxy-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one
Smiles: COc1cc2c(cc1OC)c(c(n2S(=O)(=O)c1ccc(cc1)C)CCC(=O)C)c1cccc(c1)Br

STK535148
Synonyms: 4-[4-methyl-6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-2-yl]morpholine
Smiles: CN1CCN(CC1)c1nc(nc(c1[N+](=O)[O-])C)N1CCOCC1

STK535149
Synonyms: 4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-8-fluoro-5H-pyrimido[5,4-b]indole
Smiles: Fc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCC2(CC1)OCCO2

STK535150
Synonyms: (2E)-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-[(2-methoxydibenzo[b,d]furan-3-yl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cc2oc3c(c2cc1OC)cccc3)/c1scc(n1)c1ccc(cc1)F

STK535151
Synonyms: ethyl3,3,3-trifluoro-N-[(3-methylphenyl)carbonyl]-2-[(6-methylpyridin-2-yl)amino]alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1cccc(c1)C)Nc1cccc(n1)C

STK535152
Synonyms: (2E)-3-{[2-(2-chloro-1,1,2-trifluoroethoxy)phenyl]amino}-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccccc1OC(C(Cl)F)(F)F)/c1scc(n1)c1ccc(c(c1)OC)OC

STK535153
Synonyms: (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)OCCO2)/c1scc(n1)c1cccc(c1)Br

STK535154
Synonyms: 2-({(E)-2-cyano-2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzamide
Smiles: N#C/C(=C\Nc1ccccc1C(=O)N)/c1scc(n1)c1ccc(c(c1)Cl)Cl

STK535156
Synonyms: methyl5-bromo-3-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cc(Cl)ccc1C)cc(cc2)Br

STK535158
Synonyms: (4Z)-4-(4-ethoxy-3-methoxybenzylidene)-2-(naphthalen-1-yl)-1,3-oxazol-5(4H)-one
Smiles: CCOc1ccc(cc1OC)/C=C/1\N=C(OC1=O)c1cccc2c1cccc2

STK535159
Synonyms: ethyl(2E)-{[1-(4-methylphenyl)-1H-tetrazol-5-yl]sulfanyl}[2-(3-nitrophenyl)hydrazinylidene]ethanoate
Smiles: CCOC(=O)/C(=N\Nc1cccc(c1)[N+](=O)[O-])/Sc1nnnn1c1ccc(cc1)C

STK535160
Synonyms: 3-bromo-N-[(1E)-3-{[2-(1H-indol-3-yl)ethyl]amino}-1-(naphthalen-1-yl)-3-oxoprop-1-en-2-yl]benzamide
Smiles: Brc1cccc(c1)C(=O)N/C(=C/c1cccc2c1cccc2)/C(=O)NCCc1c[nH]c2c1cccc2

STK535161
Synonyms: methyl2-[4-({[(2,4-dichlorophenyl)carbonyl]carbamothioyl}amino)phenyl]-3,3,3-trifluoro-2-hydroxypropanoate
Smiles: COC(=O)C(C(F)(F)F)(c1ccc(cc1)NC(=S)NC(=O)c1ccc(cc1Cl)Cl)O

STK535163
Synonyms: (2E)-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-[(2-oxo-2H-chromen-6-yl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)ccc(=O)o2)/c1scc(n1)c1ccc(cc1)C

STK535164
Synonyms: N-{1,1,1,3,3,3-hexafluoro-2-[(6-methylpyridin-2-yl)amino]propan-2-yl}-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)NC(C(F)(F)F)(C(F)(F)F)Nc1cccc(n1)C

STK535165
Synonyms: 2-hydrazinyl-6-phenylpyrimidine-4-carbonitrile
Smiles: NNc1nc(C#N)cc(n1)c1ccccc1

STK535166
Synonyms: 6-amino-4-heptyl-2-thioxo-1,2-dihydropyridine-3,5-dicarbonitrile
Smiles: CCCCCCCc1c(C#N)c(N)[nH]c(=S)c1C#N

STK535167
Synonyms: N'-[2-hydroxy-3-methyl-2-(propan-2-yl)butanoyl]-3-nitro-N-phenylbenzohydrazide
Smiles: O=C(N(c1ccccc1)NC(=O)C(C(C)C)(C(C)C)O)c1cccc(c1)[N+](=O)[O-]

STK535168
Synonyms: N-{2-[(2,4-difluorophenyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}-2-methylbutanamide
Smiles: CCC(C(=O)NC(C(F)(F)F)(C(F)(F)F)Nc1ccc(cc1F)F)C

STK535169
Synonyms: N-(furan-2-ylmethyl)-12-propyl-9,10-dihydro-9,10-ethanoanthracene-11-carboxamide
Smiles: CCCC1C(C(=O)NCc2ccco2)C2c3c(C1c1c2cccc1)cccc3

STK535170
Synonyms: (2Z)-2-[2-(4-bromophenyl)-2-oxoethylidene]-4,5-diphenyl-1,2-dihydro-3H-pyrrol-3-one
Smiles: Brc1ccc(cc1)C(=O)/C=C/1\NC(=C(C1=O)c1ccccc1)c1ccccc1

STK535171
Synonyms: (2E)-3-({4-chloro-2-[(3,4,5-trimethoxyphenyl)carbonyl]phenyl}amino)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C(=O)c1cc(OC)c(c(c1)OC)OC)Cl)/c1scc(n1)c1ccc(c(c1)OC)OC

STK535172
Synonyms: N-{1-(4-hydroxyphthalazin-1-yl)-2-[(2E)-2-(2-methylbenzylidene)hydrazinyl]-2-oxoethyl}benzamide
Smiles: O=C(c1ccccc1)NC(c1nnc(c2c1cccc2)O)C(=O)N/N=C/c1ccccc1C

STK535173
Synonyms: 3,3-bis(4-chlorophenyl)-3',5'-diphenyl-3H,3'H-spiro[2-benzothiophene-1,2'-[1,3,4]thiadiazole]
Smiles: Clc1ccc(cc1)C1(SC2(c3c1cccc3)SC(=NN2c1ccccc1)c1ccccc1)c1ccc(cc1)Cl

STK535174
Synonyms: 2-chloro-3-{[3-(propan-2-yloxy)propyl]amino}naphthalene-1,4-dione
Smiles: CC(OCCCNC1=C(Cl)C(=O)c2c(C1=O)cccc2)C

STK535175
Synonyms: (2E)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-[(2-methylquinolin-8-yl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cccc2c1nc(C)cc2)/c1scc(n1)c1ccc2c(c1)OCO2

STK535177
Synonyms: ethyl1-{5-[(3-methylphenyl)amino]-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-3-yl}piperidine-3-carboxylate
Smiles: CCOC(=O)C1CCCN(C1)c1cc(Nc2cccc(c2)C)c2c3c1noc3c1c(C2=O)cccc1

STK535178
Synonyms: 1-(3,3,3'-triphenyl-3H,3'H-spiro[2-benzothiophene-1,2'-[1,3,4]thiadiazol]-5'-yl)ethanone
Smiles: CC(=O)C1=NN(C2(S1)SC(c1c2cccc1)(c1ccccc1)c1ccccc1)c1ccccc1

STK535179
Synonyms: 7-benzyl-8-[(2E)-2-benzylidenehydrazinyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1n(C)c2nc(n(c2c(=O)n1C)Cc1ccccc1)N/N=C/c1ccccc1

STK535180
Synonyms: 8-{(2Z)-2-[1-(4-hydroxyphenyl)ethylidene]hydrazinyl}-1,3-dimethyl-7-(2-methylprop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(=C)Cn1c(N/N=C(\c2ccc(cc2)O)/C)nc2c1c(=O)n(c(=O)n2C)C

STK535182
Synonyms: (2E)-3-[(4-methyl-2-oxo-2H-chromen-7-yl)amino]-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)oc(=O)cc2C)/c1scc(n1)c1ccccc1

STK535183
Synonyms: [5-(morpholin-4-ylmethyl)-4,6-diphenyl-1-(phenylamino)-1,2,3,4-tetrahydropyridin-3-yl](phenyl)methanone
Smiles: O=C(C1CN(Nc2ccccc2)C(=C(C1c1ccccc1)CN1CCOCC1)c1ccccc1)c1ccccc1

STK535184
Synonyms: 4-hydroxy-2-oxo-N'-[(E)-pyridin-4-ylmethylidene]-1,2-dihydroquinoline-3-carbohydrazide
Smiles: O=C(c1c(=O)[nH]c2c(c1O)cccc2)N/N=C/c1ccncc1

STK535185
Synonyms: methyl4-ethyl-2-({1,1,1,3,3,3-hexafluoro-2-[(pyridin-3-ylcarbonyl)amino]propan-2-yl}amino)-5-methylthiophene-3-carboxylate
Smiles: COC(=O)c1c(sc(c1CC)C)NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1cccnc1

STK535186
Synonyms: (2Z)-4-(4-bromophenyl)-4-oxo-2-{[3-(trifluoromethyl)phenyl]amino}but-2-enoicacid
Smiles: Brc1ccc(cc1)C(=O)/C=C(/C(=O)O)\Nc1cccc(c1)C(F)(F)F

STK535188
Synonyms: 3-acetylphenyl2-(4-bromophenyl)quinoline-4-carboxylate
Smiles: Brc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)Oc1cccc(c1)C(=O)C

STK535189
Synonyms: 3-[2-(4-chloro-3-ethylphenoxy)ethyl]-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: CCc1cc(OCCn2c(nc3c(c2=O)cccc3)c2ccc(cc2)Cl)ccc1Cl

STK535190
Synonyms: 2-(3-methylpiperidin-1-yl)-1-(8-methyl-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)ethanone
Smiles: CC1CCCN(C1)CC(=O)N1CCc2c(C1)c1cc(C)ccc1[nH]2

STK535191
Synonyms: ethylN-1,3-benzothiazol-2-yl-3,3,3-trifluoro-2-(propanoylamino)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1nc2c(s1)cccc2)NC(=O)CC

STK535192
Synonyms: 1-decyl-N-(6-fluoro-1,3-benzothiazol-2-yl)-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: CCCCCCCCCCn1c2ccccc2c(c(c1=O)C(=O)Nc1nc2c(s1)cc(cc2)F)O

STK535193
Synonyms: ethyl[(2E)-2-(4-methoxybenzylidene)hydrazinyl](oxo)acetate
Smiles: CCOC(=O)C(=O)N/N=C/c1ccc(cc1)OC

STK535197
Synonyms: (2E)-3-[(2-acetyl-4,5-dimethoxyphenyl)amino]-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cc(OC)c(cc1C(=O)C)OC)/c1scc(n1)c1ccccc1

STK535198
Synonyms: 4,4,7,7-tetranitro-2-phenyl-4,5,6,7-tetrahydro-2H-benzotriazole
Smiles: [O-][N+](=O)C1(CCC(c2c1nn(n2)c1ccccc1)([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

STK535199
Synonyms: (4Z)-4-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-2-(4-bromophenyl)-1,3-oxazol-5(4H)-one
Smiles: Brc1ccc(cc1)C1=N/C(=C\c2cc3OCOc3cc2Br)/C(=O)O1

STK535200
Synonyms: 2-(4-chlorophenyl)-3-[4-(2,6-dimethylphenoxy)butyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCOc1c(C)cccc1C

STK535201
Synonyms: 3-{[(E)-(1-benzyl-1H-indol-3-yl)methylidene]amino}-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cn(c2c1cccc2)Cc1ccccc1

STK535203
Synonyms: 2-(4-bromophenyl)-4-(4-nitrophenyl)-6H-1,3-oxazin-6-one
Smiles: Brc1ccc(cc1)c1oc(=O)cc(n1)c1ccc(cc1)[N+](=O)[O-]

STK535204
Synonyms: 3,3'-[benzene-1,4-diylbis(oxy)]bis{1-[4-(5,5-dimethyl-4,5-dihydro-1,3-thiazol-2-yl)piperazin-1-yl]propan-2-ol}
Smiles: OC(CN1CCN(CC1)C1=NCC(S1)(C)C)COc1ccc(cc1)OCC(CN1CCN(CC1)C1=NCC(S1)(C)C)O

STK535205
Synonyms: 4-bromo-2-[(E)-{[1-{[(E)-(2,4-dichlorophenyl)methylidene]amino}-4-(4-methoxyphenyl)-1H-imidazol-2-yl]imino}methyl]phenol
Smiles: COc1ccc(cc1)c1nc(n(c1)/N=C/c1ccc(cc1Cl)Cl)/N=C/c1cc(Br)ccc1O

STK535208
Synonyms: [(1,3-benzothiazol-2-ylmethyl)sulfanyl]aceticacid
Smiles: OC(=O)CSCc1nc2c(s1)cccc2

STK535209
Synonyms: (2E)-2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-3-(quinolin-6-ylamino)prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)cccn2)/c1scc(n1)c1ccc(c(c1)Cl)Cl

STK535210
Synonyms: 3-[5-(2-tert-butyl-4-methylphenoxy)pentyl]-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCOc1ccc(cc1C(C)(C)C)C

STK535213
Synonyms: 4-{(E)-[(4-bromophenyl)imino]methyl}-2-phenyl-1,3-oxazol-5-ylacetate
Smiles: CC(=O)Oc1oc(nc1/C=N/c1ccc(cc1)Br)c1ccccc1

STK535214
Synonyms: 2-(4-chlorophenyl)-3-[6-(2,5-dichlorophenoxy)hexyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCCOc1cc(Cl)ccc1Cl

STK535215
Synonyms: 2-(4-methyl-3-nitrophenyl)-4-(4-nitrophenyl)-6H-1,3-oxazin-6-one
Smiles: O=c1cc(nc(o1)c1ccc(c(c1)[N+](=O)[O-])C)c1ccc(cc1)[N+](=O)[O-]

STK535216
Synonyms: N-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-2-(3,4-dimethoxyphenyl)ethanamine
Smiles: COc1cc(CC/N=C/c2c(C)nn(c2Cl)c2ccccc2)ccc1OC

STK535217
Synonyms: (2E)-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-{[2-oxo-4-(trifluoromethyl)-2H-chromen-7-yl]amino}prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)oc(=O)cc2C(F)(F)F)/c1scc(n1)c1ccc(cc1)OC

STK535218
Synonyms: 1-(4-fluorobenzyl)-3-[1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl]urea
Smiles: Fc1ccc(cc1)CNC(=O)NC(C(F)(F)F)(C(F)(F)F)Oc1ccc(cc1)F

STK535219
Synonyms: (2E)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-{[2-oxo-4-(trifluoromethyl)-2H-chromen-7-yl]amino}prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)oc(=O)cc2C(F)(F)F)/c1scc(n1)c1ccc(c(c1)OC)OC

STK535220
Synonyms: 2-({(E)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)benzamide
Smiles: N#C/C(=C\Nc1ccccc1C(=O)N)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK535221
Synonyms: 5-(4-bromophenyl)-3-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: Brc1ccc(cc1)c1cc(n2c(n1)c(Cl)c(n2)C(=O)Nc1cc(ccc1Cl)C(F)(F)F)C(F)(F)F

STK535222
Synonyms: 2-(4-chlorophenyl)-3-[5-(4-ethylphenoxy)pentyl]quinazolin-4(3H)-one
Smiles: CCc1ccc(cc1)OCCCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl

STK535223
Synonyms: N-(2,5-dichlorophenyl)-5-(4-fluorophenyl)-7-methylpyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: Fc1ccc(cc1)c1cc(C)n2c(n1)cc(n2)C(=O)Nc1cc(Cl)ccc1Cl

STK535224
Synonyms: (2E)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-({2-[(trifluoromethyl)sulfanyl]phenyl}amino)prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccccc1SC(F)(F)F)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK535225
Synonyms: 3-{2-[2-(4-chlorophenoxy)ethoxy]ethyl}-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)OCCOCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl

STK535226
Synonyms: (4Z)-2-(2-chloro-5-iodophenyl)-4-(4-methoxy-3-nitrobenzylidene)-1,3-oxazol-5(4H)-one
Smiles: COc1ccc(cc1[N+](=O)[O-])/C=C/1\N=C(OC1=O)c1cc(I)ccc1Cl

STK535227
Synonyms: (2,4-dichlorophenyl)(4,5-dimethoxy-2-nitrophenyl)methanone
Smiles: COc1cc(c(cc1OC)[N+](=O)[O-])C(=O)c1ccc(cc1Cl)Cl

STK535228
Synonyms: {[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl}aceticacid
Smiles: OC(=O)CSc1ncnc2c1c(cs2)c1ccc(cc1)C

STK535229
Synonyms: (2E)-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-({2-[(trifluoromethyl)sulfanyl]phenyl}amino)prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccccc1SC(F)(F)F)/c1scc(n1)c1ccc(cc1)C

STK535231
Synonyms: 3-[4-(2-chloro-4,6-dimethylphenoxy)butyl]-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCOc1c(C)cc(cc1Cl)C

STK535232
Synonyms: 4-hydroxy-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-(3-methylbutyl)-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: CC(CCn1c(=O)c(C(=O)Nc2ccc(cc2)c2sc3c(n2)ccc(c3)C)c(c2c1cccc2)O)C

STK535233
Synonyms: 2-({(E)-2-cyano-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzamide
Smiles: N#C/C(=C\Nc1ccccc1C(=O)N)/c1scc(n1)c1ccc(cc1)F

STK535234
Synonyms: N-(5-bromopyridin-2-yl)-4-butylbenzamide
Smiles: CCCCc1ccc(cc1)C(=O)Nc1ccc(cn1)Br

STK535235
Synonyms: 4-bromo-2-[(E)-(pyridin-2-ylimino)methyl]naphthalen-1-ol
Smiles: Brc1cc(/C=N/c2ccccn2)c(c2c1cccc2)O

STK535236
Synonyms: (2E)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-({4-chloro-2-[(3,4,5-trimethoxyphenyl)carbonyl]phenyl}amino)prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C(=O)c1cc(OC)c(c(c1)OC)OC)Cl)/c1scc(n1)c1ccc2c(c1)OCO2

STK535237
Synonyms: methyl2-({(E)-2-cyano-2-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]ethenyl}amino)-4,5-dimethoxybenzoate
Smiles: N#C/C(=C\Nc1cc(OC)c(cc1C(=O)OC)OC)/c1scc(n1)c1ccc(c(c1)C)C

STK535238
Synonyms: 2-(4-chlorophenyl)-3-[3-(2,5-dichlorophenoxy)propyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cc(Cl)ccc1Cl

STK535239
Synonyms: (4Z)-2-(2-bromophenyl)-4-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\c1ccc(o1)c1cccc(c1)C(F)(F)F)c1ccccc1Br

STK535240
Synonyms: 1-{(E)-[(4-chlorophenyl)imino]methyl}-6,7,8,9-tetrahydrodibenzo[b,d]furan-2-ol
Smiles: Clc1ccc(cc1)/N=C/c1c(O)ccc2c1c1CCCCc1o2

STK535241
Synonyms: 2,7-bis[(diethylamino)methyl]-1,8-bis(4-ethoxyphenyl)octane-1,8-dione
Smiles: CCN(CC(C(=O)c1ccc(cc1)OCC)CCCCC(C(=O)c1ccc(cc1)OCC)CN(CC)CC)CC

STK535242
Synonyms: 7-(2-chlorobenzyl)-8-{(2Z)-2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)/C(=N\Nc1nc2c(n1Cc1ccccc1Cl)c(=O)n(c(=O)n2C)C)/C

STK535243
Synonyms: 3-(2-bromo-4,5-dimethoxyphenyl)-2-(3,4-dimethoxyphenyl)propanenitrile
Smiles: N#CC(c1ccc(c(c1)OC)OC)Cc1cc(OC)c(cc1Br)OC

STK535244
Synonyms: 3-[3-(4-tert-butylphenoxy)propyl]-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccc(cc1)C(C)(C)C

STK535245
Synonyms: (4Z)-4-(4-ethoxy-3-methoxybenzylidene)-2-(3-iodophenyl)-1,3-oxazol-5(4H)-one
Smiles: CCOc1ccc(cc1OC)/C=C/1\N=C(OC1=O)c1cccc(c1)I

STK535246
Synonyms: methyl2-({(E)-2-cyano-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzoate
Smiles: N#C/C(=C\Nc1ccccc1C(=O)OC)/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]

STK535247
Synonyms: (2E)-3-[(2-bromo-4-methylphenyl)amino]-2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: COc1cccc(c1)c1csc(n1)/C(=C/Nc1ccc(cc1Br)C)/C#N

STK535248
Synonyms: N'-(2-hydroxy-2-propylpentanoyl)-3-nitro-N-phenylbenzohydrazide
Smiles: CCCC(C(=O)NN(C(=O)c1cccc(c1)[N+](=O)[O-])c1ccccc1)(CCC)O

STK535249
Synonyms: 3-nitro-N'-[3-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)propanoyl]benzohydrazide
Smiles: O=C(CCn1c2ccccc2c2c1CCCC2)NNC(=O)c1cccc(c1)[N+](=O)[O-]

STK535250
Synonyms: (2E)-3-[(2-acetyl-4,5-dimethoxyphenyl)amino]-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: COc1ccc(cc1)c1csc(n1)/C(=C/Nc1cc(OC)c(cc1C(=O)C)OC)/C#N

STK535252
Synonyms: 4-(2,5-dichlorophenyl)-2,3',5'-triphenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]
Smiles: Clc1ccc(c(c1)C1=NN(c2ccccc2)C2(c3c1cccc3)SC(=NN2c1ccccc1)c1ccccc1)Cl

STK535253
Synonyms: 2-(4-chlorophenyl)-3-[4-(2,3,6-trimethylphenoxy)butyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCOc1c(C)ccc(c1C)C

STK535256
Synonyms: (2E)-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-[(2-methylquinolin-8-yl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cccc2c1nc(C)cc2)/c1scc(n1)c1ccc(cc1)F

STK535257
Synonyms: 2-(4-chlorophenyl)-3-{6-[3-(propan-2-yl)phenoxy]hexyl}quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCCOc1cccc(c1)C(C)C

STK535258
Synonyms: methyl2-{[(E)-(5-bromo-2-hydroxyphenyl)methylidene]amino}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
Smiles: COC(=O)c1c(/N=C/c2cc(Br)ccc2O)sc2c1CCN(C2)C

STK535259
Synonyms: (8S,8aR,11aS,11bS)-10-(4-fluorophenyl)-8-(phenylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: Fc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)c2ccccc2)N=Cc2c1cccc2

STK535260
Synonyms: 2-[4-(2-chloro-6-nitrophenoxy)phenyl]-2-oxoethyl4-(4-methyl-1,3-dioxo-1,3-dihydro-2H-pyrrolo[3,4-c]quinolin-2-yl)benzoate
Smiles: O=C(c1ccc(cc1)N1C(=O)c2c(C1=O)c(C)nc1c2cccc1)OCC(=O)c1ccc(cc1)Oc1c(Cl)cccc1[N+](=O)[O-]

STK535261
Synonyms: ethyl1-[6-oxo-5-(phenylamino)-6H-anthra[1,9-cd][1,2]oxazol-3-yl]piperidine-3-carboxylate
Smiles: CCOC(=O)C1CCCN(C1)c1cc(Nc2ccccc2)c2c3c1noc3c1c(C2=O)cccc1

STK535262
Synonyms: N'-[(3Z)-5-bromo-2-(3-methylphenyl)-3H-indol-3-ylidene]-2-hydroxy-2,2-bis(3-methylphenyl)acetohydrazide
Smiles: Brc1ccc2c(c1)/C(=N/NC(=O)C(c1cccc(c1)C)(c1cccc(c1)C)O)/C(=N2)c1cccc(c1)C

STK535263
Synonyms: 4-(4-hydrazinyl-6-methyl-5-nitropyrimidin-2-yl)morpholine
Smiles: NNc1nc(nc(c1[N+](=O)[O-])C)N1CCOCC1

STK535264
Synonyms: 4-hydroxy-2-oxo-N'-[(E)-pyridin-3-ylmethylidene]-1,2-dihydroquinoline-3-carbohydrazide
Smiles: O=C(c1c(=O)[nH]c2c(c1O)cccc2)N/N=C/c1cccnc1

STK535265
Synonyms: (4Z)-4-[2,4-bis(benzyloxy)benzylidene]-2-(2-chloro-4-nitrophenyl)-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\c1ccc(cc1OCc1ccccc1)OCc1ccccc1)c1ccc(cc1Cl)[N+](=O)[O-]

STK535266
Synonyms: (6aR,6bS,9aR,10S)-8-(4-chlorophenyl)-10-(phenylcarbonyl)-9a,10-dihydro-6aH-benzo[f]pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)c2ccccc2)c2ccc3c(c2C=C1)cccc3

STK535267
Synonyms: 3-[benzyl(methyl)amino]-5-(phenylamino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: CN(c1cc(Nc2ccccc2)c2c3c1noc3c1c(C2=O)cccc1)Cc1ccccc1

STK535268
Synonyms: methyl5-chloro-3-{[(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCc3c(C1)cc(c(c3)OC)OC)cc(cc2)Cl

STK535269
Synonyms: methyl5,6-dimethoxy-3-{[(4-phenylpiperazin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1)cc(c(c2)OC)OC

STK535270
Synonyms: (2E)-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-[(4-methyl-2-oxo-2H-chromen-7-yl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)oc(=O)cc2C)/c1scc(n1)c1ccc(cc1)F

STK535273
Synonyms: (2E)-3-{[2-(2-chloro-1,1,2-trifluoroethoxy)phenyl]amino}-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccccc1OC(C(Cl)F)(F)F)/c1scc(n1)c1ccc(cc1)F

STK535274
Synonyms: 1-[(E)-(benzylimino)methyl]-3-tert-butyl-6,7,8,9-tetrahydrodibenzo[b,d]furan-2-ol
Smiles: Oc1c(/C=N/Cc2ccccc2)c2c(cc1C(C)(C)C)oc1c2CCCC1

STK535275
Synonyms: N-{2-[2-(4-methoxyphenyl)-1H-imidazo[1,2-a]benzimidazol-1-yl]ethyl}cyclohexanamine
Smiles: COc1ccc(cc1)c1cn2c(n1CCNC1CCCCC1)nc1c2cccc1

STK535276
Synonyms: 2-(4-chlorophenyl)-3-[6-(2,6-dichlorophenoxy)hexyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCCOc1c(Cl)cccc1Cl

STK535277
Synonyms: (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-[(2-methoxydibenzo[b,d]furan-3-yl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cc2oc3c(c2cc1OC)cccc3)/c1scc(n1)c1cccc(c1)Br

STK535279
Synonyms: ethyl2-({[3-bromo-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(sc2c1CCCCC2)NC(=O)c1nn2c(c1Br)nc(cc2C(F)(F)F)c1cccs1

STK535280
Synonyms: ethyl3'-(4-bromophenyl)-3,3-bis(4-methylphenyl)-3H,3'H-spiro[2-benzothiophene-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Smiles: CCOC(=O)C1=NN(C2(S1)SC(c1c2cccc1)(c1ccc(cc1)C)c1ccc(cc1)C)c1ccc(cc1)Br

STK535281
Synonyms: methyl2-{hydroxy[bis(4-methylphenyl)]acetyl}-1-phenylhydrazinecarboxylate
Smiles: COC(=O)N(c1ccccc1)NC(=O)C(c1ccc(cc1)C)(c1ccc(cc1)C)O

STK535282
Synonyms: methyl2-({(E)-2-cyano-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]ethenyl}amino)-4,5-dimethoxybenzoate
Smiles: N#C/C(=C\Nc1cc(OC)c(cc1C(=O)OC)OC)/c1scc(n1)c1ccc(cc1)C

STK535283
Synonyms: 1-[1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl]-3-(4-methoxyphenyl)urea
Smiles: COc1ccc(cc1)NC(=O)NC(C(F)(F)F)(C(F)(F)F)Oc1ccc(cc1)F

STK535286
Synonyms: 2-(4-chlorophenyl)-3-{2-[2-methyl-5-(propan-2-yl)phenoxy]ethyl}quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1cc(ccc1C)C(C)C

STK535287
Synonyms: 3-[3-(4-bromo-2,6-dimethylphenoxy)propyl]-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1c(C)cc(cc1C)Br

STK535289
Synonyms: (2E)-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-[(3,4,5-trimethoxyphenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cc(OC)c(c(c1)OC)OC)/c1scc(n1)c1ccc(cc1)F

STK535290
Synonyms: N'-[(E)-(3-methoxyphenyl)methylidene]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carbohydrazide
Smiles: COc1cccc(c1)/C=N/NC(=O)c1nn2c(n1)nc(cc2C)C

STK535292
Synonyms: 3-tert-butyl-N-cyclohexyl-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
Smiles: O=C(c1n(C)nc(c1[N+](=O)[O-])C(C)(C)C)NC1CCCCC1

STK535293
Synonyms: 2-hydroxy-2-pentyl-N'-phenylheptanehydrazide
Smiles: CCCCCC(C(=O)NNc1ccccc1)(CCCCC)O

STK535294
Synonyms: ethylN-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-3,3,3-trifluoro-2-[(phenylcarbonyl)amino]alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1sc2c(c1C#N)CCCCCC2)NC(=O)c1ccccc1

STK535297
Synonyms: (2E)-3-[(4-fluorophenyl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)F)/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]

STK535299
Synonyms: N'-[1-(4-methoxyphenyl)ethylidene]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carbohydrazide
Smiles: COc1ccc(cc1)/C(=N/NC(=O)c1nn2c(n1)nc(cc2C)C)/C

STK535300
Synonyms: 6-{(E)-2-[4-(diethylamino)-3-nitrophenyl]ethenyl}-5-nitropyrimidine-2,4-diol
Smiles: CCN(c1ccc(cc1[N+](=O)[O-])/C=C/c1nc(O)nc(c1[N+](=O)[O-])O)CC

STK535301
Synonyms: 2-{(E)-[(6-methylpyridin-2-yl)imino]methyl}naphthalen-1-ol
Smiles: Cc1cccc(n1)/N=C/c1ccc2c(c1O)cccc2

STK535303
Synonyms: ethyl2-({[5-(4-bromophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2nn3c(c2)NC(CC3C(F)(F)F)c2ccc(cc2)Br)sc2c1CCC(C2)C

STK535304
Synonyms: (4Z)-2-(3-chlorophenyl)-4-(3-methoxy-4-propoxybenzylidene)-1,3-oxazol-5(4H)-one
Smiles: CCCOc1ccc(cc1OC)/C=C/1\N=C(OC1=O)c1cccc(c1)Cl

STK535305
Synonyms: 2-[4-(2-chloro-6-nitrophenoxy)phenyl]-2-oxoethyl5-methyl-3-phenyl-1,2-oxazole-4-carboxylate
Smiles: O=C(c1ccc(cc1)Oc1c(Cl)cccc1[N+](=O)[O-])COC(=O)c1c(C)onc1c1ccccc1

STK535306
Synonyms: (4Z)-4-(2,3-dimethoxybenzylidene)-2-(naphthalen-2-yl)-1,3-oxazol-5(4H)-one
Smiles: COc1c(cccc1OC)/C=C/1\N=C(OC1=O)c1ccc2c(c1)cccc2

STK535307
Synonyms: ethyl4-(4-tert-butylphenyl)-3'-(4-methylphenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Smiles: CCOC(=O)C1=NN(C2(S1)N(N=C(c1c2cccc1)c1ccc(cc1)C(C)(C)C)c1ccccc1)c1ccc(cc1)C

STK535308
Synonyms: (2E)-3-{[2-(2-chloro-1,1,2-trifluoroethoxy)phenyl]amino}-2-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccccc1OC(C(Cl)F)(F)F)/c1scc(n1)c1ccc(cc1C)C

STK535309
Synonyms: methyl3-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5,6-dimethoxy-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCC3(CC1)OCCO3)cc(c(c2)OC)OC

STK535310
Synonyms: N'-{(E)-[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carbohydrazide
Smiles: Cc1cc(C)n2c(n1)nc(n2)C(=O)N/N=C/c1ccc(o1)c1cc(ccc1Cl)[N+](=O)[O-]

STK535311
Synonyms: (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-[(2-methylquinolin-8-yl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cccc2c1nc(C)cc2)/c1scc(n1)c1cccc(c1)Br

STK535312
Synonyms: 3-acetyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-1H-indol-5-yl2-bromobenzoate
Smiles: COc1cc(ccc1OC)CCn1c2ccc(cc2c(c1C)C(=O)C)OC(=O)c1ccccc1Br

STK535313
Synonyms: N-benzyl-4-methyl-6-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}pyrimidin-2-amine
Smiles: Cc1cc(N/N=C(/c2ccc(cc2)[N+](=O)[O-])\C)nc(n1)NCc1ccccc1

STK535315
Synonyms: 9-(4-methylphenyl)-2-(3-nitrophenyl)tetrahydro-5H-pyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3(2H,3aH)-dione
Smiles: Cc1ccc(cc1)C1N2CCCN2C2C1C(=O)N(C2=O)c1cccc(c1)[N+](=O)[O-]

STK535316
Synonyms: methyl2-({(E)-2-cyano-2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]ethenyl}amino)-4,5-dimethoxybenzoate
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1cc(OC)c(cc1C(=O)OC)OC)/C#N

STK535318
Synonyms: (2E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)OCCO2)/c1scc(n1)c1ccc(cc1)Cl

STK535319
Synonyms: N-(3-chlorophenyl)-2-(pyridin-3-yl)quinazolin-4-amine
Smiles: Clc1cccc(c1)Nc1nc(nc2c1cccc2)c1cccnc1

STK535320
Synonyms: 2,2'-(1,3,4-thiadiazole-2,5-diyldisulfanediyl)bis{N'-[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]propanehydrazide}
Smiles: COc1cccc(c1O)/C=N/NC(=O)C(Sc1nnc(s1)SC(C(=O)N/N=C/c1cccc(c1O)OC)C)C

STK535321
Synonyms: (4Z)-4-(4-ethoxy-3,5-diiodobenzylidene)-2-(naphthalen-2-yl)-1,3-oxazol-5(4H)-one
Smiles: CCOc1c(I)cc(cc1I)/C=C/1\N=C(OC1=O)c1ccc2c(c1)cccc2

STK535323
Synonyms: (2E)-3-{[2-(difluoromethoxy)phenyl]amino}-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccccc1OC(F)F)/c1scc(n1)c1ccc(cc1)OC

STK535325
Synonyms: methyl2-amino-3-cyano-6-methylpyridine-4-carboxylate
Smiles: COC(=O)c1cc(C)nc(c1C#N)N

STK535326
Synonyms: 2-[(E)-{2-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]hydrazinylidene}methyl]phenol
Smiles: Cc1ccc(cc1)c1csc2c1c(N/N=C/c1ccccc1O)ncn2

STK535328
Synonyms: methyl2-({3-ethoxy-2-[(ethoxycarbonyl)amino]-1,1,1-trifluoro-3-oxopropan-2-yl}amino)-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1sc2c(c1C(=O)OC)CCN(C2)C)NC(=O)OCC

STK535329
Synonyms: 2-iminotetrahydro-8a,3-(epoxymethano)chromene-3,4,4(2H,4aH)-tricarbonitrile
Smiles: N#CC1(C#N)C2CCCCC32OCC1(C#N)C(=N)O3

STK535330
Synonyms: (2E)-3-{[2-(2-chloro-1,1,2-trifluoroethoxy)phenyl]amino}-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: COc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccccc1OC(C(Cl)F)(F)F)/C#N

STK535332
Synonyms: ethyl1-(4-chlorophenyl)-4-[4-(diethylamino)phenyl]-5-(thiophen-2-yl)-4,5-dihydro-1H-1,2,4-triazole-3-carboxylate
Smiles: CCOC(=O)C1=NN(C(N1c1ccc(cc1)N(CC)CC)c1cccs1)c1ccc(cc1)Cl

STK535333
Synonyms: 2,4-diiodo-6-[(E)-(pyridin-2-ylimino)methyl]phenol
Smiles: Ic1cc(/C=N/c2ccccn2)c(c(c1)I)O

STK535335
Synonyms: (2E)-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-(quinolin-6-ylamino)prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)cccn2)/c1scc(n1)c1ccc(cc1)C

STK535336
Synonyms: 3-(2-methoxyphenyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one
Smiles: COc1ccccc1n1cnc2c(c1=O)c(C)c(s2)C

STK535337
Synonyms: (4Z)-4-[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-2-(4-iodophenyl)-1,3-oxazol-5(4H)-one
Smiles: Ic1ccc(cc1)C1=N/C(=C\c2c(C)nn(c2Cl)c2ccccc2)/C(=O)O1

STK535338
Synonyms: 4-hydroxy-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-oxo-1-pentyl-1,2-dihydroquinoline-3-carboxamide
Smiles: CCCCCn1c(=O)c(C(=O)Nc2ccc(cc2)c2nc3c(s2)cc(cc3)C)c(c2c1cccc2)O

STK535339
Synonyms: 3-[4-(2-bromophenoxy)butyl]-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCOc1ccccc1Br

STK535340
Synonyms: N-[(1Z)-1-(4-bromophenyl)-3-{[2-(1H-indol-3-yl)ethyl]amino}-3-oxoprop-1-en-2-yl]-4-tert-butylbenzamide
Smiles: Brc1ccc(cc1)/C=C(/C(=O)NCCc1c[nH]c2c1cccc2)\NC(=O)c1ccc(cc1)C(C)(C)C

STK535341
Synonyms: N'-[hydroxy(diphenyl)acetyl]-N-phenyloctanehydrazide
Smiles: CCCCCCCC(=O)N(c1ccccc1)NC(=O)C(c1ccccc1)(c1ccccc1)O

STK535342
Synonyms: (2Z)-2-[(13E)-13-(2-carbamoylhydrazinylidene)hexadecan-4-ylidene]hydrazinecarboxamide
Smiles: CCC/C(=N/NC(=O)N)/CCCCCCCC/C(=N/NC(=O)N)/CCC

STK535343
Synonyms: (1S,2R,3aR)-1-(2,2-dimethylpropanoyl)-7-methyl-2-(thiophen-3-yl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Smiles: N#CC1(C#N)[C@H](c2cscc2)[C@H](N2[C@@H]1C=Cc1c2ccc(c1)C)C(=O)C(C)(C)C

STK535344
Synonyms: (2Z)-2-[2-(2,4-dinitrophenyl)hydrazinylidene]-2-(1H-indol-3-yl)-N',N'-diphenylethanehydrazide
Smiles: O=C(/C(=N\Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/c1c[nH]c2c1cccc2)NN(c1ccccc1)c1ccccc1

STK535346
Synonyms: (1Z)-1-[3-(4-chlorophenyl)-6,6-dimethyl-2-nitro-3,5,6,7-tetrahydro-1-benzofuran-4(2H)-ylidene]-2-phenylhydrazine
Smiles: [O-][N+](=O)C1OC2=C(C1c1ccc(cc1)Cl)/C(=N\Nc1ccccc1)/CC(C2)(C)C

STK535347
Synonyms: (2E)-3-[(4-methoxy-2-nitrophenyl)amino]-2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: COc1ccc(c(c1)[N+](=O)[O-])N/C=C(/c1scc(n1)c1cccc(c1)OC)\C#N

STK535350
Synonyms: 7-tert-butyl-2-(3-nitrophenyl)-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
Smiles: O=C1NC(Nc2c1c1CCC(Cc1s2)C(C)(C)C)c1cccc(c1)[N+](=O)[O-]

STK535352
Synonyms: N'-[(2Z)-butan-2-ylidene]-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carbohydrazide
Smiles: CC/C(=N\NC(=O)c1c(=O)[nH]c2c(c1O)cccc2)/C

STK535353
Synonyms: ethyl2-{[(3-iodophenyl)carbonyl]amino}-4-(4-methoxyphenyl)thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccc(cc1)OC)NC(=O)c1cccc(c1)I

STK535354
Synonyms: (3E)-N-(2,4-dichlorophenyl)-3-[2-(pyridin-4-ylcarbonyl)hydrazinylidene]butanamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)C/C(=N/NC(=O)c1ccncc1)/C

STK535355
Synonyms: 3-bromo-1-[(E)-{[4-(dimethylamino)phenyl]imino}methyl]-6,7,8,9-tetrahydrodibenzo[b,d]furan-2-ol
Smiles: Brc1cc2oc3c(c2c(c1O)/C=N/c1ccc(cc1)N(C)C)CCCC3

STK535356
Synonyms: 2-hydroxy-2,2-bis(4-methoxyphenyl)-N'-[(1Z)-1-phenylbutylidene]acetohydrazide
Smiles: CCC/C(=N/NC(=O)C(c1ccc(cc1)OC)(c1ccc(cc1)OC)O)/c1ccccc1

STK535360
Synonyms: (2E)-3-({4-chloro-2-[(3,4,5-trimethoxyphenyl)carbonyl]phenyl}amino)-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C(=O)c1cc(OC)c(c(c1)OC)OC)Cl)/c1scc(n1)c1ccc(cc1)C

STK535362
Synonyms: (2E)-2-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-({2-[(trifluoromethyl)sulfanyl]phenyl}amino)prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccccc1SC(F)(F)F)/c1scc(n1)c1ccc(c(c1)C)C

STK535363
Synonyms: (2E)-3-[5-(2-bromophenyl)furan-2-yl]-2-cyano-N,N-diethylprop-2-enamide
Smiles: CCN(C(=O)/C(=C/c1ccc(o1)c1ccccc1Br)/C#N)CC

STK535364
Synonyms: (2E)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-({4-chloro-2-[(3,4,5-trimethoxyphenyl)carbonyl]phenyl}amino)prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C(=O)c1cc(OC)c(c(c1)OC)OC)Cl)/c1scc(n1)c1ccc(cc1)Br

STK535365
Synonyms: methyl2-[hydroxy(diphenyl)acetyl]-1-(4-methylphenyl)hydrazinecarboxylate
Smiles: COC(=O)N(c1ccc(cc1)C)NC(=O)C(c1ccccc1)(c1ccccc1)O

STK535366
Synonyms: 5-(2,4-dichlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl(1E)-N-(3-nitrophenyl)-2-oxopropanehydrazonothioate
Smiles: Clc1ccc(c(c1)Cl)c1nnc(n1c1ccccc1)S/C(=N/Nc1cccc(c1)[N+](=O)[O-])/C(=O)C

STK535367
Synonyms: 3-tert-butyl-N-(2,4-dimethylphenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
Smiles: Cc1ccc(c(c1)C)NC(=O)c1n(C)nc(c1[N+](=O)[O-])C(C)(C)C

STK535369
Synonyms: ethyl5-methoxy-3-({2-[4-(2-methoxyphenyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)C(N1CCN(CC1)c1ccccc1OC)C)cc(cc2)OC

STK535372
Synonyms: (2E)-2-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-[(2-methoxydibenzo[b,d]furan-3-yl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cc2oc3c(c2cc1OC)cccc3)/c1scc(n1)c1ccc(c(c1)C)C

STK535374
Synonyms: 3-(2-methylphenyl)-5-[(4-methylphenyl)amino]-3H-anthra[1,2-d][1,2,3]triazole-6,11-dione
Smiles: Cc1ccc(cc1)Nc1cc2c(c3c1C(=O)c1ccccc1C3=O)nnn2c1ccccc1C

STK535375
Synonyms: (2E)-2-(1H-benzimidazol-2-yl)-3-[5-(2-hydroxy-5-nitrophenyl)furan-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\c1ccc(o1)c1cc(ccc1O)[N+](=O)[O-])/c1nc2c([nH]1)cccc2

STK535376
Synonyms: (4Z)-2-(naphthalen-1-yl)-4-(3-propoxybenzylidene)-1,3-oxazol-5(4H)-one
Smiles: CCCOc1cccc(c1)/C=C/1\N=C(OC1=O)c1cccc2c1cccc2

STK535377
Synonyms: 2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-1-(5-methoxy-1H-indol-3-yl)ethanone
Smiles: COc1ccc2c(c1)c(c[nH]2)C(=O)CN1CCN(CC1)C(=O)c1ccco1

STK535378
Synonyms: 4-(4-bromophenyl)-2-(5-chloro-2-methoxyphenyl)-6H-1,3-oxazin-6-one
Smiles: COc1ccc(cc1c1oc(=O)cc(n1)c1ccc(cc1)Br)Cl

STK535380
Synonyms: ethyl(6aR,6bS,9aR,10S)-8-(4-chlorophenyl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-benzo[f]pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxylate
Smiles: CCOC(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1c1ccc3c(c1C=C2)cccc3)c1ccc(cc1)Cl

STK535381
Synonyms: 5-(4-bromophenyl)-N-(3-nitro-5-phenoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: Brc1ccc(cc1)C1Nc2cc(nn2C(C1)C(F)(F)F)C(=O)Nc1cc(Oc2ccccc2)cc(c1)[N+](=O)[O-]

STK535383
Synonyms: 3-{[(E)-1,3-benzodioxol-5-ylmethylidene]amino}-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc2c(c1)OCO2

STK535385
Synonyms: (2Z)-2-hydroxy-4-(4-methoxyphenyl)-4-oxo-N-phenylbut-2-enamide
Smiles: COc1ccc(cc1)C(=O)/C=C(/C(=O)Nc1ccccc1)\O

STK535386
Synonyms: 8-bromo-3-(2,2-dimethoxyethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COC(Cn1cnc2c(c1=O)[nH]c1c2cc(cc1)Br)OC

STK535387
Synonyms: 2-(4-chlorophenyl)-3-{3-[3-(propan-2-yl)phenoxy]propyl}quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cccc(c1)C(C)C

STK535388
Synonyms: 2-hydroxy-N'-[(E)-(3-phenylbicyclo[2.2.1]hepta-2,5-dien-2-yl)methylidene]benzohydrazide
Smiles: O=C(c1ccccc1O)N/N=C/C1=C(C2CC1C=C2)c1ccccc1

STK535389
Synonyms: N'-(chloroacetyl)-2-hydroxy-2,2-bis(4-methylphenyl)-N'-phenylacetohydrazide
Smiles: ClCC(=O)N(c1ccccc1)NC(=O)C(c1ccc(cc1)C)(c1ccc(cc1)C)O

STK535390
Synonyms: 2-(4-nitrophenyl)-2-oxoethyl2-chloroquinoline-4-carboxylate
Smiles: Clc1nc2ccccc2c(c1)C(=O)OCC(=O)c1ccc(cc1)[N+](=O)[O-]

STK535391
Synonyms: 2-(4-chlorophenyl)-3-{4-[5-methyl-2-(propan-2-yl)phenoxy]butyl}quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCOc1cc(C)ccc1C(C)C

STK535393
Synonyms: 8-bromo-7-heptyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCn1c(Br)nc2c1c(=O)n(C)c(=O)n2C

STK535394
Synonyms: N'-[(E)-(4-methoxyphenyl)methylidene]-2-{[5-(4-methylphenyl)-4-oxo-3-phenyl-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)CSc1nc2scc(c2c(=O)n1c1ccccc1)c1ccc(cc1)C

STK535395
Synonyms: 2-hydroxy-2,2-bis(4-methylphenyl)-N'-phenylacetohydrazide
Smiles: Cc1ccc(cc1)C(c1ccc(cc1)C)(C(=O)NNc1ccccc1)O

STK535397
Synonyms: 2-hydroxy-2,2-bis(3-methylphenyl)-N'-[(3E)-2-(3-methylphenyl)-3H-indol-3-ylidene]acetohydrazide
Smiles: Cc1cccc(c1)C1=Nc2c(/C/1=N\NC(=O)C(c1cccc(c1)C)(c1cccc(c1)C)O)cccc2

STK535398
Synonyms: (2E)-3-({4-chloro-2-[(3,4,5-trimethoxyphenyl)carbonyl]phenyl}amino)-2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc(cc1C(=O)c1cc(OC)c(c(c1)OC)OC)Cl)/C#N

STK535399
Synonyms: 2-[4-(heptyloxy)phenyl]-4-[(E)-2-phenylethenyl]-6H-1,3-oxazin-6-one
Smiles: CCCCCCCOc1ccc(cc1)c1nc(/C=C/c2ccccc2)cc(=O)o1

STK535401
Synonyms: 3-[3-(2-tert-butylphenoxy)propyl]-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccccc1C(C)(C)C

STK535402
Synonyms: 8-chloro-3-(2-methoxybenzyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccccc1Cn1cnc2c(c1=O)[nH]c1c2cc(cc1)Cl

STK535403
Synonyms: 3-phenyl-5-(phenylamino)-3H-anthra[1,2-d][1,2,3]triazole-6,11-dione
Smiles: O=C1c2ccccc2C(=O)c2c1c(Nc1ccccc1)cc1c2nnn1c1ccccc1

STK535404
Synonyms: (2E)-3-({4-chloro-2-[(3,4,5-trimethoxyphenyl)carbonyl]phenyl}amino)-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C(=O)c1cc(OC)c(c(c1)OC)OC)Cl)/c1scc(n1)c1cc2ccccc2oc1=O

STK535405
Synonyms: 1-[4-(4-tert-butylphenyl)-3'-(3-chlorophenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazol]-5'-yl]ethanone
Smiles: Clc1cccc(c1)N1N=C(SC21N(N=C(c1c2cccc1)c1ccc(cc1)C(C)(C)C)c1ccccc1)C(=O)C

STK535406
Synonyms: 3-[6-(4-chloro-3,5-dimethylphenoxy)hexyl]-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCCOc1cc(C)c(c(c1)C)Cl

STK535407
Synonyms: 2-(4-chlorophenyl)-3-[3-(2,4-dichloro-6-methylphenoxy)propyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1c(C)cc(cc1Cl)Cl

STK535408
Synonyms: 5-cyano-6-({2-[(3,5-dichlorophenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(Cl)cc(c2)Cl)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1)C

STK535409
Synonyms: hexyl2-({(E)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)benzoate
Smiles: CCCCCCOC(=O)c1ccccc1N/C=C(/c1scc(n1)c1ccc2c(c1)OCO2)\C#N

STK535410
Synonyms: 2,2'-(piperazine-1,4-diyldibutane-4,1-diyl)bis(1H-isoindole-1,3(2H)-dione)
Smiles: O=C1N(CCCCN2CCN(CC2)CCCCN2C(=O)c3c(C2=O)cccc3)C(=O)c2c1cccc2

STK535412
Synonyms: (6aR,6bS,9aR,10S)-8-(2,4-dimethoxyphenyl)-10-(phenylcarbonyl)-9a,10-dihydro-6aH-benzo[f]pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COc1ccc(c(c1)OC)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1ccc1c2cccc1)C(=O)c1ccccc1

STK535413
Synonyms: N,N-dimethyl-4-[(2,6,8-trimethylquinolin-4-yl)amino]benzamide
Smiles: Cc1cc(C)c2c(c1)c(Nc1ccc(cc1)C(=O)N(C)C)cc(n2)C

STK535415
Synonyms: 1-[(2-hydroxyethyl)amino]-N-(2-methylpropyl)-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
Smiles: OCCNc1c(ccc2c1C(=O)c1ccccc1C2=O)C(=O)NCC(C)C

STK535416
Synonyms: methyl2-({(E)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-4,5-dimethoxybenzoate
Smiles: N#C/C(=C\Nc1cc(OC)c(cc1C(=O)OC)OC)/c1scc(n1)c1ccc2c(c1)OCO2

STK535417
Synonyms: methyl5-chloro-3-{[N-(1,3-dioxolan-2-ylmethyl)-N-methylglycyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN(CC1OCCO1)C)cc(cc2)Cl

STK535418
Synonyms: 2-amino-4-(4-bromo-2-fluorophenyl)-5-oxo-4H,5H-pyrano[3,2-c]chromene-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1F)Br)c(=O)oc1c2cccc1

STK535419
Synonyms: ethyl3,3,3-trifluoro-2-hydroxy-2-{4-[methyl(naphthalen-2-ylcarbamoyl)amino]phenyl}propanoate
Smiles: CCOC(=O)C(C(F)(F)F)(c1ccc(cc1)N(C(=O)Nc1ccc2c(c1)cccc2)C)O

STK535420
Synonyms: 3-tert-butyl-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
Smiles: [O-][N+](=O)c1c(C(=O)N)n(nc1C(C)(C)C)C

STK535421
Synonyms: (2E)-3-{[2-(difluoromethoxy)phenyl]amino}-2-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccccc1OC(F)F)/c1scc(n1)c1ccc(c(c1)C)C

STK535422
Synonyms: (2E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)OCCO2)/c1scc(n1)c1ccc(cc1)C

STK535423
Synonyms: N-{(1E)-3-[(3-bromophenyl)amino]-1-[4-(methylsulfanyl)phenyl]-3-oxoprop-1-en-2-yl}-4-methylbenzamide
Smiles: CSc1ccc(cc1)/C=C(\C(=O)Nc1cccc(c1)Br)/NC(=O)c1ccc(cc1)C

STK535424
Synonyms: (2E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc2c(c1)OCCO2)/C#N

STK535426
Synonyms: 7-tert-butyl-2-(4-hydroxyphenyl)-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
Smiles: Oc1ccc(cc1)C1NC(=O)c2c(N1)sc1c2CCC(C1)C(C)(C)C

STK535427
Synonyms: 7-(2-chlorobenzyl)-8-{(2Z)-2-[1-(4-hydroxyphenyl)ethylidene]hydrazinyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Oc1ccc(cc1)/C(=N\Nc1nc2c(n1Cc1ccccc1Cl)c(=O)n(c(=O)n2C)C)/C

STK535428
Synonyms: N'-cyclohexylidene-2,2-bis(4-ethoxyphenyl)-2-hydroxyacetohydrazide
Smiles: CCOc1ccc(cc1)C(c1ccc(cc1)OCC)(C(=O)NN=C1CCCCC1)O

STK535429
Synonyms: 2-(biphenyl-4-yloxy)-4-(4-chlorophenyl)-6-(trifluoromethyl)pyrimidine
Smiles: Clc1ccc(cc1)c1nc(Oc2ccc(cc2)c2ccccc2)nc(c1)C(F)(F)F

STK535430
Synonyms: (2E)-3-[(2-acetyl-4,5-dimethoxyphenyl)amino]-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cc(OC)c(cc1C(=O)C)OC)/c1scc(n1)c1ccc(cc1)F

STK535433
Synonyms: ethyl2-{[(E)-(3-ethoxy-2-hydroxyphenyl)methylidene]amino}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
Smiles: CCOC(=O)c1c(/N=C/c2cccc(c2O)OCC)sc2c1CCN(C2)C

STK535434
Synonyms: (8S,8aR,11aS,11bS)-10-(4-fluorophenyl)-8-(phenylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Fc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)c2ccccc2)C=Cc2c1cccc2

STK535435
Synonyms: 1-{(E)-[(4-bromophenyl)imino]methyl}-3-iodo-6,7,8,9-tetrahydrodibenzo[b,d]furan-2-ol
Smiles: Brc1ccc(cc1)/N=C/c1c(O)c(I)cc2c1c1CCCCc1o2

STK535436
Synonyms: 1-(4-methoxyphenyl)-N-(4'-nitrobiphenyl-4-yl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: COc1ccc(cc1)n1c(=O)c(cc2c1CCCC2=O)C(=O)Nc1ccc(cc1)c1ccc(cc1)[N+](=O)[O-]

STK535437
Synonyms: (2Z)-2-[1-(benzylamino)ethylidene]-1-benzothiophen-3(2H)-one
Smiles: C/C(=C\1/Sc2c(C1=O)cccc2)/NCc1ccccc1

STK535438
Synonyms: 2-(4-chlorophenyl)-3-[2-(naphthalen-1-yloxy)ethyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1cccc2c1cccc2

STK535441
Synonyms: 4-{[(6-bromo-2-hydroxynaphthalen-1-yl)methyl]amino}benzoicacid
Smiles: Brc1ccc2c(c1)ccc(c2CNc1ccc(cc1)C(=O)O)O

STK535443
Synonyms: 4-{4-[(2E)-2-(2-fluorobenzylidene)hydrazinyl]-6-methylpyrimidin-2-yl}morpholine
Smiles: Cc1cc(N/N=C/c2ccccc2F)nc(n1)N1CCOCC1

STK535444
Synonyms: 1-[4-(4-tert-butylphenyl)-3'-(3-nitrophenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazol]-5'-yl]ethanone
Smiles: CC(=O)C1=NN(C2(S1)N(N=C(c1c2cccc1)c1ccc(cc1)C(C)(C)C)c1ccccc1)c1cccc(c1)[N+](=O)[O-]

STK535445
Synonyms: (2E)-3-[(2-bromo-4-methylphenyl)amino]-2-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1Br)C)/c1scc(n1)c1ccc(cc1C)C

STK535446
Synonyms: 2-(4-chlorophenyl)-3-[4-(naphthalen-2-yloxy)butyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCOc1ccc2c(c1)cccc2

STK535447
Synonyms: 2-hydroxy-2,2-bis(2-methoxyphenyl)acetohydrazide
Smiles: NNC(=O)C(c1ccccc1OC)(c1ccccc1OC)O

STK535450
Synonyms: (2E)-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}-3-[(3,4,5-trimethoxyphenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cc(OC)c(c(c1)OC)OC)/c1scc(n1)c1ccc(cc1)CC(C)C

STK535452
Synonyms: methyl3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]-N-(pyridin-3-ylcarbonyl)alaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1cccnc1)Nc1scc(n1)C

STK535453
Synonyms: 8-[(2E)-2-(3-chloro-4-hydroxy-5-methoxybenzylidene)hydrazinyl]-7-(2-hydroxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCn1c(N/N=C/c2cc(Cl)c(c(c2)OC)O)nc2c1c(=O)n(c(=O)n2C)C

STK535454
Synonyms: (2E)-3-[(2-bromo-4-methylphenyl)amino]-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1Br)C)/c1scc(n1)c1ccc(cc1)F

STK535455
Synonyms: (2E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-[(3,4,5-trimethoxyphenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cc(OC)c(c(c1)OC)OC)/c1scc(n1)c1ccc(cc1)Cl

STK535456
Synonyms: N-[(1Z)-3-(2-chlorophenyl)-1-({2-[(3-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-2-cyano-5-oxo-5-phenylpent-1-en-1-yl]benzamide
Smiles: N#C/C(=C(/NC(=O)c1ccccc1)\SCC(=O)Nc1cccc(c1)Cl)/C(c1ccccc1Cl)CC(=O)c1ccccc1

STK535457
Synonyms: quinolin-8-yldiphenylborinate
Smiles: c1ccc(cc1)B(c1ccccc1)Oc1cccc2c1nccc2

STK535458
Synonyms: (2E)-2-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-[(4-methoxy-2-nitrophenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1[N+](=O)[O-])OC)/c1scc(n1)c1ccc(cc1C)C

STK535464
Synonyms: (4Z)-4-(3,5-di-tert-butyl-4-hydroxybenzylidene)-2-(4-fluorophenyl)-1,3-oxazol-5(4H)-one
Smiles: Fc1ccc(cc1)C1=N/C(=C\c2cc(c(c(c2)C(C)(C)C)O)C(C)(C)C)/C(=O)O1

STK535466
Synonyms: ethyl5-(3-chlorophenyl)-1-(4-chlorophenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)c1cccc(c1)Cl)c1ccc(cc1)Cl

STK535468
Synonyms: (4Z)-4-(4-ethoxy-3-methoxybenzylidene)-2-(4-fluorophenyl)-1,3-oxazol-5(4H)-one
Smiles: CCOc1ccc(cc1OC)/C=C/1\N=C(OC1=O)c1ccc(cc1)F

STK535469
Synonyms: methyl(2,4-dinitro-1H-imidazol-1-yl)acetate
Smiles: COC(=O)Cn1cc(nc1[N+](=O)[O-])[N+](=O)[O-]

STK535470
Synonyms: 1-(2,4-dimethylphenyl)-3-(3,5-dimethyl-1H-pyrazol-1-yl)pyrrolidine-2,5-dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)CC(C1=O)n1nc(cc1C)C

STK535471
Synonyms: methyl3-({2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propanoyl}amino)-5-methyl-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)C(N1CCN(CC1)c1cc(Cl)ccc1C)C)cc(cc2)C

STK535472
Synonyms: 2-(3-chlorophenyl)-9-(4-methoxyphenyl)tetrahydro-5H-pyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3(2H,3aH)-dione
Smiles: COc1ccc(cc1)C1N2CCCN2C2C1C(=O)N(C2=O)c1cccc(c1)Cl

STK535473
Synonyms: (8S,8aR,11aS,11bS)-10-phenyl-8-(phenylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: O=C([C@H]1N2C=Cc3c([C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1)cccc3)c1ccccc1

STK535475
Synonyms: (4Z)-2-(naphthalen-2-yl)-4-[(2E)-3-(3-nitrophenyl)prop-2-en-1-ylidene]-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\C=C\c1cccc(c1)[N+](=O)[O-])c1ccc2c(c1)cccc2

STK535476
Synonyms: ethyl2-(acetylamino)-N-[5-(3-ethoxy-1,1,1-trifluoro-2-hydroxy-3-oxopropan-2-yl)-2-methylphenyl]-3,3,3-trifluoroalaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1cc(ccc1C)C(C(F)(F)F)(C(=O)OCC)O)NC(=O)C

STK535477
Synonyms: (2E,2'E)-3,3'-(benzene-1,4-diyldiimino)bis[1-(3-methoxyphenyl)prop-2-en-1-one]
Smiles: COc1cccc(c1)C(=O)/C=C/Nc1ccc(cc1)N/C=C/C(=O)c1cccc(c1)OC

STK535478
Synonyms: (4Z)-2-(4-chloro-3-nitrophenyl)-4-(3-ethoxy-4-propoxybenzylidene)-1,3-oxazol-5(4H)-one
Smiles: CCCOc1ccc(cc1OCC)/C=C/1\N=C(OC1=O)c1ccc(c(c1)[N+](=O)[O-])Cl

STK535479
Synonyms: 3-(3-bromophenyl)-5-[(4-methylphenyl)amino]-3H-anthra[1,2-d][1,2,3]triazole-6,11-dione
Smiles: Cc1ccc(cc1)Nc1cc2c(c3c1C(=O)c1ccccc1C3=O)nnn2c1cccc(c1)Br

STK535480
Synonyms: 2-amino-6-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-4-[4-(propan-2-yl)phenyl]pyridine-3,5-dicarbonitrile
Smiles: COc1ccc(cc1)C(=O)CSc1nc(N)c(c(c1C#N)c1ccc(cc1)C(C)C)C#N

STK535481
Synonyms: 2-[2-(3,4-dimethoxybenzyl)-1H-benzimidazol-1-yl]-N'-[(E)-(3-hydroxy-1-benzothiophen-2-yl)methylidene]acetohydrazide
Smiles: COc1cc(ccc1OC)Cc1nc2c(n1CC(=O)N/N=C/c1sc3c(c1O)cccc3)cccc2

STK535482
Synonyms: 2-(3-bromophenyl)-9-phenyltetrahydro-5H-pyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3(2H,3aH)-dione
Smiles: Brc1cccc(c1)N1C(=O)C2C(C1=O)C(N1N2CCC1)c1ccccc1

STK535483
Synonyms: 2-(4-chlorophenyl)-3-[4-(2,4-dichloro-6-methylphenoxy)butyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCOc1c(C)cc(cc1Cl)Cl

STK535484
Synonyms: (2E)-3-{[4-chloro-2-(phenylcarbonyl)phenyl]amino}-2-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C(=O)c1ccccc1)Cl)/c1scc(n1)c1ccc(cc1)CC

STK535485
Synonyms: 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-5-(phenylamino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: O=C1c2ccccc2c2c3c1c(Nc1ccccc1)cc(c3no2)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK535486
Synonyms: methyl2-{[(E)-2-cyano-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}ethenyl]amino}benzoate
Smiles: N#C/C(=C\Nc1ccccc1C(=O)OC)/c1scc(n1)c1ccc(cc1)CC(C)C

STK535487
Synonyms: (2E)-3-[(2-bromo-4-methylphenyl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1Br)C)/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]

STK535488
Synonyms: N'~1~,N'~2~-bis(2,5-dimethylphenyl)ethanedihydrazide
Smiles: O=C(C(=O)NNc1cc(C)ccc1C)NNc1cc(C)ccc1C

STK535489
Synonyms: (2E)-3-[(2-acetyl-4,5-dimethoxyphenyl)amino]-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cc(OC)c(cc1C(=O)C)OC)/c1scc(n1)c1cc2ccccc2oc1=O

STK535490
Synonyms: 9,10-bis(4-methoxyphenyl)-10H-imidazo[1,2-a]naphtho[1,2-d]imidazole
Smiles: COc1ccc(cc1)n1c(cn2c1nc1c2ccc2c1cccc2)c1ccc(cc1)OC

STK535491
Synonyms: 2-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)-4-methoxy-6-nitrophenol
Smiles: COc1cc(C2SCc3c(CS2)cc(c(c3)C)C)c(c(c1)[N+](=O)[O-])O

STK535492
Synonyms: (6aR,6bS,9aR,10S)-8-(2-methyl-5-nitrophenyl)-10-(phenylcarbonyl)-9a,10-dihydro-6aH-benzo[f]pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: O=C([C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1c1ccc3c(c1C=C2)cccc3)c1cc(ccc1C)[N+](=O)[O-])c1ccccc1

STK535493
Synonyms: N-[1,1,1,3,3,3-hexafluoro-2-(phenylamino)propan-2-yl]pyridine-3-carboxamide
Smiles: O=C(c1cccnc1)NC(C(F)(F)F)(C(F)(F)F)Nc1ccccc1

STK535494
Synonyms: (2E)-3-{[4-chloro-2-(phenylcarbonyl)phenyl]amino}-2-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C(=O)c1ccccc1)Cl)/c1scc(n1)c1ccc(cc1C)C

STK535495
Synonyms: dimethyl2-({(E)-2-cyano-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]ethenyl}amino)benzene-1,4-dicarboxylate
Smiles: N#C/C(=C\Nc1cc(ccc1C(=O)OC)C(=O)OC)/c1scc(n1)c1cc2ccccc2oc1=O

STK535496
Synonyms: 9-(4-methoxyphenyl)-2-(3-nitrophenyl)tetrahydro-5H-pyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3(2H,3aH)-dione
Smiles: COc1ccc(cc1)C1N2CCCN2C2C1C(=O)N(C2=O)c1cccc(c1)[N+](=O)[O-]

STK535497
Synonyms: ethyl4-[2-(8-methyl-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)-2-oxoethyl]piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)CC(=O)N1CCc2c(C1)c1cc(C)ccc1[nH]2

STK535498
Synonyms: N-(2,3-dichlorophenyl)-5-(4-ethoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: CCOc1ccc(cc1)c1cc(C)n2c(n1)cc(n2)C(=O)Nc1cccc(c1Cl)Cl

STK535499
Synonyms: 1-benzyl-3-[(nonyloxy)methyl]-1,3-dihydro-2H-benzimidazol-2-imine
Smiles: CCCCCCCCCOCn1c(=N)n(c2c1cccc2)Cc1ccccc1

STK535501
Synonyms: 6-methyl-2-(morpholin-4-yl)-5-nitro-N-(4-nitrophenyl)pyrimidin-4-amine
Smiles: [O-][N+](=O)c1c(Nc2ccc(cc2)[N+](=O)[O-])nc(nc1C)N1CCOCC1

STK535502
Synonyms: (2E)-3-[(4-methoxy-2-nitrophenyl)amino]-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1[N+](=O)[O-])OC)/c1scc(n1)c1ccc(cc1)C

STK535503
Synonyms: (4Z)-4-(3-ethoxy-4-propoxybenzylidene)-2-(thiophen-2-yl)-1,3-oxazol-5(4H)-one
Smiles: CCCOc1ccc(cc1OCC)/C=C/1\N=C(OC1=O)c1cccs1

STK535504
Synonyms: 2-{(E)-[(5-chloropyridin-2-yl)imino]methyl}-4-methyl-6-nitrophenol
Smiles: Clc1ccc(nc1)/N=C/c1cc(C)cc(c1O)[N+](=O)[O-]

STK535505
Synonyms: 3-methyl-8-[(2-phenylethyl)amino]-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)c2c(n1C)nc(n2CCCc1ccccc1)NCCc1ccccc1

STK535506
Synonyms: 8-(hexylamino)-3-methyl-7-pentyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCNc1nc2c(n1CCCCC)c(=O)[nH]c(=O)n2C

STK535508
Synonyms: hexyl2-({(E)-2-cyano-2-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzoate
Smiles: CCCCCCOC(=O)c1ccccc1N/C=C(/c1scc(n1)c1ccc(c(c1)C)C)\C#N

STK535509
Synonyms: N-(2-hydroxyethyl)-1-[(2-hydroxyethyl)amino]-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
Smiles: OCCNc1c(ccc2c1C(=O)c1ccccc1C2=O)C(=O)NCCO

STK535510
Synonyms: (6aR,6bS,9aR,10S)-8-(4-chlorophenyl)-10-(phenylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)c1ccccc1

STK535511
Synonyms: (4Z)-4-(4-ethoxy-3,5-diiodobenzylidene)-2-(2-fluorophenyl)-1,3-oxazol-5(4H)-one
Smiles: CCOc1c(I)cc(cc1I)/C=C/1\N=C(OC1=O)c1ccccc1F

STK535515
Synonyms: 2-(4-chlorophenyl)-2-oxoethyl6,7,8,9,10,11,12,13,14,15-decahydrocyclododeca[b]quinoline-16-carboxylate
Smiles: Clc1ccc(cc1)C(=O)COC(=O)c1c2CCCCCCCCCCc2nc2c1cccc2

STK535516
Synonyms: 3-[4-(2-bromo-4,6-dimethylphenoxy)butyl]-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCOc1c(C)cc(cc1Br)C

STK535517
Synonyms: 3-[benzyl(methyl)amino]-5-[(2-methylphenyl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: Cc1ccccc1Nc1cc(N(Cc2ccccc2)C)c2c3c1C(=O)c1ccccc1c3on2

STK535518
Synonyms: 5-(2,4-dichlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl(1E)-N-(4-methoxyphenyl)-2-oxopropanehydrazonothioate
Smiles: COc1ccc(cc1)N/N=C(\C(=O)C)/Sc1nnc(n1c1ccccc1)c1ccc(cc1Cl)Cl

STK535519
Synonyms: 2-{(E)-[(8-bromo-2,3-dihydro-1,4-benzodioxin-6-yl)imino]methyl}-4-nitrophenol
Smiles: Oc1ccc(cc1/C=N/c1cc(Br)c2c(c1)OCCO2)[N+](=O)[O-]

STK535520
Synonyms: ethyl4-[(2E)-3-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)triaz-2-en-1-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N/N=N/c1[nH]c2c(n1)n(C)c(=O)n(c2=O)C

STK535521
Synonyms: N-[3,5-bis(4-fluorophenoxy)phenyl]-3-bromo-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: Fc1ccc(cc1)Oc1cc(cc(c1)Oc1ccc(cc1)F)NC(=O)c1nn2c(c1Br)NC(CC2C(F)(F)F)c1ccccc1

STK535523
Synonyms: (2E)-3-[(4-acetylphenyl)amino]-2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)C(=O)C)/c1scc(n1)c1ccc(c(c1)Cl)Cl

STK535524
Synonyms: 2-(4-chlorophenyl)-3-[2-(4-methylphenoxy)ethyl]quinazolin-4(3H)-one
Smiles: Cc1ccc(cc1)OCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl

STK535525
Synonyms: (4Z)-2-(2-chloro-4,5-difluorophenyl)-4-(2-propoxybenzylidene)-1,3-oxazol-5(4H)-one
Smiles: CCCOc1ccccc1/C=C/1\N=C(OC1=O)c1cc(F)c(cc1Cl)F

STK535526
Synonyms: 7-benzyl-8-[(2-chlorobenzyl)sulfanyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccccc1CSc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C

STK535528
Synonyms: N'-[(E)-furan-2-ylmethylidene]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carbohydrazide
Smiles: Cc1cc(C)n2c(n1)nc(n2)C(=O)N/N=C/c1ccco1

STK535530
Synonyms: methyl5-methyl-3-{[2-(thiomorpholin-4-yl)propanoyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)C(N1CCSCC1)C)cc(cc2)C

STK535532
Synonyms: (4Z)-2-(furan-2-yl)-4-[4-(propan-2-yl)benzylidene]-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\c1ccc(cc1)C(C)C)c1ccco1

STK535533
Synonyms: 7-chloro-N-[4-chloro-2-(trifluoromethyl)phenyl]-4-nitro-2,1,3-benzoxadiazol-5-amine
Smiles: Clc1ccc(c(c1)C(F)(F)F)Nc1cc(Cl)c2c(c1[N+](=O)[O-])non2

STK535534
Synonyms: 8-[(2E)-but-2-en-1-ylsulfanyl]-7-(2-chlorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: C/C=C/CSc1nc2c(n1Cc1ccccc1Cl)c(=O)n(c(=O)n2C)C

STK535535
Synonyms: 2-[(E)-{2-[6-methyl-2-(morpholin-4-yl)pyrimidin-4-yl]hydrazinylidene}methyl]-5-propoxyphenol
Smiles: CCCOc1ccc(c(c1)O)/C=N/Nc1cc(C)nc(n1)N1CCOCC1

STK535537
Synonyms: 2-hydroxy-2,2-bis(4-methoxyphenyl)-N'-methyl-N'-phenylacetohydrazide
Smiles: COc1ccc(cc1)C(c1ccc(cc1)OC)(C(=O)NN(c1ccccc1)C)O

STK535538
Synonyms: (2E)-3-({4-chloro-2-[(3,4,5-trimethoxyphenyl)carbonyl]phenyl}amino)-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C(=O)c1cc(OC)c(c(c1)OC)OC)Cl)/c1scc(n1)c1ccc(cc1)CC(C)C

STK535540
Synonyms: ethyl2-[4-({[(2,4-dichlorophenyl)carbonyl]carbamothioyl}amino)-3-methoxyphenyl]-3,3,3-trifluoro-2-hydroxypropanoate
Smiles: CCOC(=O)C(C(F)(F)F)(c1ccc(c(c1)OC)NC(=S)NC(=O)c1ccc(cc1Cl)Cl)O

STK535541
Synonyms: (6aR,6bS,9aR,10S)-8-(4-methoxyphenyl)-10-(phenylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)c1ccccc1

STK535543
Synonyms: 3-[3-(4-bromo-2-chlorophenoxy)propyl]-2-(4-chlorophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccc(cc1Cl)Br

STK535545
Synonyms: (2E)-3-{[4-chloro-2-(phenylcarbonyl)phenyl]amino}-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C(=O)c1ccccc1)Cl)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK535546
Synonyms: 2-(4-chlorophenyl)-3-{2-[2-(3,4-dimethylphenoxy)ethoxy]ethyl}quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOCCOc1ccc(c(c1)C)C

STK535547
Synonyms: 5-[(4-methylphenyl)amino]-3-(4-methylpiperidin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: CC1CCN(CC1)c1cc(Nc2ccc(cc2)C)c2c3c1noc3c1c(C2=O)cccc1

STK535548
Synonyms: 2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1-(8-fluoro-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)ethanone
Smiles: Fc1ccc2c(c1)c1CN(CCc1[nH]2)C(=O)CN1CCN(CC1)c1cccc(c1C)C

STK535549
Synonyms: (2E)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-[(2-methylquinolin-8-yl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cccc2c1nc(C)cc2)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK535550
Synonyms: 2-(4-chlorophenyl)-3-[2-(2,4-dichloro-6-methylphenoxy)ethyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1c(C)cc(cc1Cl)Cl

STK535551
Synonyms: 2-(5,7-diphenyl-1,2,3,4,4a,5-hexahydro-10H-benzimidazo[2,1-j]quinolin-10-ylidene)-1,3-diphenylpropane-1,3-dione
Smiles: O=C(/C(=c\1/ccc2=NC34N(c2c1)C(=CC(C4CCCC3)c1ccccc1)c1ccccc1)/C(=O)c1ccccc1)c1ccccc1

STK535552
Synonyms: 2-oxo-N'-phenyl-2-(piperidin-1-yl)acetohydrazide
Smiles: O=C(C(=O)N1CCCCC1)NNc1ccccc1

STK535553
Synonyms: (2E)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-[(9-ethyl-9H-carbazol-3-yl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)c1ccccc1n2CC)/c1scc(n1)c1ccc(cc1)Br

STK535554
Synonyms: 6-bromo-1-[(E)-(pyridin-2-ylimino)methyl]naphthalen-2-ol
Smiles: Brc1ccc2c(c1)ccc(c2/C=N/c1ccccn1)O

STK535555
Synonyms: 7-benzyl-1,3-dimethyl-8-(pentylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCSc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C

STK535557
Synonyms: 6-(4-chlorophenyl)-3-(4-methoxyphenyl)-N-[(E)-(4-methoxyphenyl)methylidene]-1H-imidazo[1,2-a]imidazol-1-amine
Smiles: COc1ccc(cc1)/C=N/n1cc(n2c1nc(c2)c1ccc(cc1)Cl)c1ccc(cc1)OC

STK535559
Synonyms: methyl3-({2-[4-(4-fluorophenyl)piperazin-1-yl]propanoyl}amino)-5-methyl-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)C(N1CCN(CC1)c1ccc(cc1)F)C)cc(cc2)C

STK535560
Synonyms: 2,2'-[(methylimino)bis(benzene-4,1-diylmethylylidene)]dipropanedinitrile
Smiles: CN(c1ccc(cc1)C=C(C#N)C#N)c1ccc(cc1)C=C(C#N)C#N

STK535562
Synonyms: 2-(4-chlorophenyl)-3-[2-(4-ethoxyphenoxy)ethyl]quinazolin-4(3H)-one
Smiles: CCOc1ccc(cc1)OCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl

STK535564
Synonyms: 2-butyl-N'-[(1E)-1-(4-chlorophenyl)ethylidene]-2-hydroxyhexanehydrazide
Smiles: CCCCC(C(=O)N/N=C(/c1ccc(cc1)Cl)\C)(CCCC)O

STK535565
Synonyms: N'-[(1E)-1-(4-chlorophenyl)ethylidene]-2-hydroxy-2,2-bis(4-methoxyphenyl)acetohydrazide
Smiles: COc1ccc(cc1)C(c1ccc(cc1)OC)(C(=O)N/N=C(/c1ccc(cc1)Cl)\C)O

STK535566
Synonyms: (2Z)-3-(morpholin-4-yl)-N,3-diphenylprop-2-enethioamide
Smiles: S=C(/C=C(/c1ccccc1)\N1CCOCC1)Nc1ccccc1

STK535567
Synonyms: (4Z)-4-[3-(benzyloxy)benzylidene]-2-(2,5-dichlorophenyl)-1,3-oxazol-5(4H)-one
Smiles: Clc1ccc(c(c1)C1=N/C(=C\c2cccc(c2)OCc2ccccc2)/C(=O)O1)Cl

STK535568
Synonyms: (4Z)-4-(3-chloro-4-nitrobenzylidene)-2-(furan-2-yl)-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\c1ccc(c(c1)Cl)[N+](=O)[O-])c1ccco1

STK535569
Synonyms: N-(3-bromophenyl)-1-butyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: CCCCn1c(=O)c(C(=O)Nc2cccc(c2)Br)c(c2c1cccc2)O

STK535570
Synonyms: 3-(4-chlorophenyl)-2-nitro-3,5,6,7-tetrahydro-1-benzofuran-4(2H)-one
Smiles: Clc1ccc(cc1)C1C2=C(OC1[N+](=O)[O-])CCCC2=O