FULL DB

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

STK677005
Synonyms: 5-cyano-6-({2-[(4-iodophenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-N-(2-methylphenyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)I)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1C)C

STK764054
Synonyms: 6-({2-[(4-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-methyl-N-(2-methylphenyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)Cl)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1C)C

STK677006
Synonyms: 5-cyano-6-({2-[(3,5-dichlorophenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-N-(2-methylphenyl)-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)Nc1ccccc1C)C

STK677008
Synonyms: 5-cyano-N-(2-methoxyphenyl)-2-methyl-6-[(2-oxo-2-{[4-(propan-2-yl)phenyl]amino}ethyl)sulfanyl]-4-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)C(C)C)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1OC)C

STK677009
Synonyms: 5-cyano-6-({2-[(4-iodophenyl)amino]-2-oxoethyl}sulfanyl)-N-(2-methoxyphenyl)-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)I)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1OC)C

STK764055
Synonyms: 5-cyano-6-({2-[(3-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-N-(2-methoxyphenyl)-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)F)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1OC)C

STK677010
Synonyms: 6-({2-[(5-chloro-2-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-N-(2-methoxyphenyl)-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(Cl)ccc2OC)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1OC)C

STK764057
Synonyms: 2-{[3-cyano-4-(4-ethoxy-3-methoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1OC)C1CC(=O)NC(=C1C#N)SCC(=O)Nc1cccc(c1)OC

STK764058
Synonyms: 2-{[3-cyano-4-(2-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(4-iodophenyl)acetamide
Smiles: CCOc1ccccc1C1CC(=O)NC(=C1C#N)SCC(=O)Nc1ccc(cc1)I

STK764059
Synonyms: 2-{[3-cyano-4-(2-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(2,4-dimethylphenyl)acetamide
Smiles: CCOc1ccccc1C1CC(=O)NC(=C1C#N)SCC(=O)Nc1ccc(cc1C)C

STK677011
Synonyms: 7-ethyl-1,3-dimethyl-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Smiles: CCC1=NC(c2c(N1)n(C)c(=O)n(c2=O)C)(C(F)(F)F)C(F)(F)F

STK677016
Synonyms: N~2~-carbamoylglutamine
Smiles: NC(=O)CCC(C(=O)O)NC(=O)N

STK764062
Synonyms: 6-amino-2-benzofuran-1(3H)-one
Smiles: Nc1ccc2c(c1)C(=O)OC2

STK677019
Synonyms: 2-(3-chloro-4-hydroxy-5-methoxyphenyl)-1,3-thiazolidine-4-carboxylicacid
Smiles: COc1cc(cc(c1O)Cl)C1SCC(N1)C(=O)O

STK677020
Synonyms: 2-[4-(2-amino-2-oxoethoxy)phenyl]-1,3-thiazolidine-4-carboxylicacid
Smiles: NC(=O)COc1ccc(cc1)C1SCC(N1)C(=O)O

STK677021
Synonyms: 2-(3,5-dichloro-2-hydroxyphenyl)-1,3-thiazolidine-4-carboxylicacid
Smiles: Clc1cc(Cl)c(c(c1)C1SCC(N1)C(=O)O)O

STK764067
Synonyms: 1-(4-bromophenyl)-2-(2-imino-3-methyl-2,3-dihydro-1H-benzimidazol-1-yl)ethanone
Smiles: Brc1ccc(cc1)C(=O)Cn1c(=N)n(c2c1cccc2)C

STK764070
Synonyms: 1,3-benzodioxol-5-yl(4-methyl-6-phenyl-1,5,2-dioxazinan-2-yl)methanone
Smiles: CC1CN(OC(O1)c1ccccc1)C(=O)c1ccc2c(c1)OCO2

STK764071
Synonyms: (3-tert-butyl-5-nitro-1,3-oxazinan-5-yl)methanol
Smiles: OCC1(COCN(C1)C(C)(C)C)[N+](=O)[O-]

STK764083
Synonyms: 6-chloro-2-phenyl-3H-dibenzo[de,h]cinnoline-3,7(2H)-dione
Smiles: O=c1n(nc2c3c1ccc(c3c(=O)c1c2cccc1)Cl)c1ccccc1

STK764085
Synonyms: 6-chloro-3H-dibenzo[de,h]cinnoline-3,7(2H)-dione
Smiles: Clc1ccc2c3c1c(=O)c1ccccc1c3n[nH]c2=O

STK764091
Synonyms: diethyl5-formyl-3-methyl-1H-pyrrole-2,4-dicarboxylate
Smiles: CCOC(=O)c1[nH]c(c(c1C)C(=O)OCC)C=O

STK677032
Synonyms: 2,2'-(oxydibenzene-4,1-diyl)bis[5-(trimethylsilyl)-1H-isoindole-1,3(2H)-dione]
Smiles: O=C1c2cc(ccc2C(=O)N1c1ccc(cc1)Oc1ccc(cc1)N1C(=O)c2c(C1=O)cc(cc2)[Si](C)(C)C)[Si](C)(C)C

STK764105
Synonyms: 2-{2-methoxy-4-[(Z)-(3-oxo-1-benzothiophen-2(3H)-ylidene)methyl]phenoxy}-5-nitrobenzonitrile
Smiles: COc1cc(ccc1Oc1ccc(cc1C#N)[N+](=O)[O-])/C=C/1\Sc2c(C1=O)cccc2

STK764107
Synonyms: 7-chloro-N-[4-(4-methylpiperazin-1-yl)phenyl]quinolin-4-amine
Smiles: CN1CCN(CC1)c1ccc(cc1)Nc1ccnc2c1ccc(c2)Cl

STK764108
Synonyms: ethyl6-bromo-2-{[4-(cyanomethyl)piperazin-1-yl]methyl}-5-hydroxy-1-phenyl-1H-indole-3-carboxylate
Smiles: N#CCN1CCN(CC1)Cc1n(c2ccccc2)c2c(c1C(=O)OCC)cc(c(c2)Br)O

STK764109
Synonyms: ethyl1-{2-[(6-methoxyquinolin-8-yl)carbamoyl]-4-nitrophenyl}piperidine-4-carboxylate
Smiles: CCOC(=O)C1CCN(CC1)c1ccc(cc1C(=O)Nc1cc(OC)cc2c1nccc2)[N+](=O)[O-]

STK764114
Synonyms: (4Z)-4-(furan-2-ylmethylidene)-2-(2-nitrophenyl)-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\c1ccco1)c1ccccc1[N+](=O)[O-]

STK677043
Synonyms: 2,2,5-trimethylpiperidin-3-one
Smiles: CC1CNC(C(=O)C1)(C)C

STK677044
Synonyms: N'-acetyl-2,2,3-trichloro-N-(4-nitrophenyl)propanehydrazide
Smiles: ClCC(C(=O)N(c1ccc(cc1)[N+](=O)[O-])NC(=O)C)(Cl)Cl

STK764134
Synonyms: ethyl4-[4-methoxy-2-methyl-5-(propan-2-yl)phenyl]-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(NC(=S)NC1c1cc(C(C)C)c(cc1C)OC)c1ccccc1

STK677046
Synonyms: 5-nitro-2-benzofuran-1,3-dione
Smiles: O=C1OC(=O)c2c1cc(cc2)[N+](=O)[O-]

STK677052
Synonyms: 2-[2-methyl-5-(4-methylphenyl)-2,3-dihydro-1,3,4-thiadiazol-2-yl]-N-phenylacetamide
Smiles: O=C(CC1(C)NN=C(S1)c1ccc(cc1)C)Nc1ccccc1

STK677053
Synonyms: 8-[(4-benzyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(Sc2nncn2Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK764145
Synonyms: (2-benzyl-1H-benzimidazol-1-yl)(2-chlorophenyl)methanone
Smiles: Clc1ccccc1C(=O)n1c(Cc2ccccc2)nc2c1cccc2

STK677055
Synonyms: 2-methyloctahydroquinolin-4(1H)-one
Smiles: CC1NC2CCCCC2C(=O)C1

STK764160
Synonyms: (2Z)-2-{[1-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methylidene}-6,7-dimethyl[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Smiles: Cc1ccc(cc1C)n1ncc(c1)/C=c/1\sc2n(c1=O)c1c(n2)cc(c(c1)C)C

STK764161
Synonyms: 4-amino-N'-[(2-chloro-4-fluorobenzyl)oxy]-1,2,5-oxadiazole-3-carboximidamide
Smiles: Fc1ccc(c(c1)Cl)CO/N=C(/c1nonc1N)\N

STK764162
Synonyms: (2E)-2-(1H-benzimidazol-2-yl)-3-[1-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]prop-2-enenitrile
Smiles: N#C/C(=C\c1cnn(c1)c1ccc(c(c1)C)C)/c1nc2c([nH]1)cccc2

STK764165
Synonyms: 4-(1,3-benzodioxol-5-ylmethoxy)-1,2,5-oxadiazol-3-amine
Smiles: Nc1nonc1OCc1ccc2c(c1)OCO2

STK677061
Synonyms: 8-chloro-1,3-dimethyl-7-(prop-2-yn-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: C#CCn1c(Cl)nc2c1c(=O)n(C)c(=O)n2C

STK764171
Synonyms: 2-[(3,4-dichlorobenzyl)sulfanyl]-3H-imidazo[4,5-b]pyridine
Smiles: Clc1ccc(cc1Cl)CSc1nc2c([nH]1)nccc2

STK764172
Synonyms: N-(2,4-dimethoxyphenyl)-2-(5-phenyl-2H-tetrazol-2-yl)acetamide
Smiles: COc1cc(OC)ccc1NC(=O)Cn1nnc(n1)c1ccccc1

STK764173
Synonyms: ethyl4-({[5-(4-fluorophenyl)-2H-tetrazol-2-yl]acetyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)Cn1nnc(n1)c1ccc(cc1)F

STK677064
Synonyms: 3-(2,4-difluorophenyl)benzo[f]quinoline-1-carboxylicacid
Smiles: Fc1ccc(c(c1)F)c1nc2ccc3c(c2c(c1)C(=O)O)cccc3

STK764174
Synonyms: 2-(3H-imidazo[4,5-b]pyridin-2-ylsulfanyl)-1-(morpholin-4-yl)ethanone
Smiles: O=C(N1CCOCC1)CSc1nc2c([nH]1)nccc2

STK677067
Synonyms: 2-(5-{(Z)-[3-(2,5-dimethylphenyl)-2-imino-4-oxo-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoicacid
Smiles: Cc1ccc(c(c1)N1C(=N)S/C(=C\c2ccc(o2)c2ccccc2C(=O)O)/C1=O)C

STK764181
Synonyms: (2Z)-2-{[5-(1-oxo-1,3-dihydro-2-benzofuran-5-yl)furan-2-yl]methylidene}[1,3]thiazolo[2',3':2,3]imidazo[4,5-b]pyridin-3(2H)-one
Smiles: O=C1OCc2c1ccc(c2)c1ccc(o1)/C=c/1\sc2n(c1=O)c1c(n2)cccn1

STK764183
Synonyms: 3-(1H-tetrazol-1-yl)quinoline
Smiles: c1ccc2c(c1)cc(cn2)n1cnnn1

STK764187
Synonyms: 4-(3-bromo-4-ethoxy-5-methoxyphenyl)-8-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Smiles: CCOc1c(Br)cc(cc1OC)C1Nc2ccc(cc2C2C1CC=C2)[N+](=O)[O-]

STK764190
Synonyms: 2-nitro-1-(phenylsulfanyl)-4-(trifluoromethyl)benzene
Smiles: [O-][N+](=O)c1cc(ccc1Sc1ccccc1)C(F)(F)F

STK677069
Synonyms: 5-tert-butyl-2-methylfuran-3-carboxamide
Smiles: NC(=O)c1cc(oc1C)C(C)(C)C

STK677072
Synonyms: 2-(3,3-dimethyl-7-nitro-1-oxo-2,3,4,9-tetrahydro-1H-xanthen-9-yl)-5,5-dimethylcyclohexane-1,3-dione
Smiles: O=C1CC(C)(C)CC(=O)C1C1C2=C(Oc3c1cc(cc3)[N+](=O)[O-])CC(CC2=O)(C)C

STK677073
Synonyms: (5-amino-4-cyano-2-phenylfuran-3(2H)-ylidene)propanedinitrile
Smiles: N#CC(=C1C(=C(OC1c1ccccc1)N)C#N)C#N

STK677076
Synonyms: 1-[5,6-bis(4-chlorophenyl)-2-methyl-1,2,5,6-tetrahydro-1,2,4,5-tetrazin-3-yl]ethanone
Smiles: Clc1ccc(cc1)N1N=C(C(=O)C)N(NC1c1ccc(cc1)Cl)C

STK764196
Synonyms: N'-(3-bromobenzylidene)-4-hydroxybutanehydrazide
Smiles: OCCCC(=O)N/N=C/c1cccc(c1)Br

STK764199
Synonyms: 2-(7-bromo-2-oxo-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-1-yl)-N'-[(E)-(2-hydroxyphenyl)methylidene]acetohydrazide
Smiles: O=C(CN1C(=O)CN=C(c2c1ccc(c2)Br)c1ccccc1)N/N=C/c1ccccc1O

STK764202
Synonyms: 4-hydroxy-N'-(2-nitrobenzylidene)butanehydrazide
Smiles: OCCCC(=O)N/N=C/c1ccccc1[N+](=O)[O-]

STK764203
Synonyms: N'-(5-bromo-2-hydroxybenzylidene)-4-hydroxybutanehydrazide
Smiles: Oc1ccc(cc1/C=N/NC(=O)CCCO)Br

STK764205
Synonyms: 1-(4-ethylphenyl)-4-(propan-2-ylidene)pyrazolidine-3,5-dione
Smiles: CCc1ccc(cc1)N1NC(=O)C(=C(C)C)C1=O

STK764206
Synonyms: 3-(5-tert-butyl-2-oxocyclohexyl)-3-hydroxy-1-methyl-1,3-dihydro-2H-indol-2-one
Smiles: O=C1CCC(CC1C1(O)C(=O)N(c2c1cccc2)C)C(C)(C)C

STK677081
Synonyms: 2-[2-(5-sulfanyl-1H-1,2,4-triazol-3-yl)ethyl]-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(CCc2n[nH]c(n2)S)C(=O)c2c1cccc2

STK677084
Synonyms: N-(5,5-dioxido-6H-dibenzo[c,e][1,2]thiazin-9-yl)-4-methylbenzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)Nc1ccc2c(c1)c1ccccc1S(=O)(=O)N2

STK764214
Synonyms: 5-amino-3-(4-methoxyphenyl)-4,8-dimethyl-7-oxo-6-azabicyclo[3.2.1]octane-1,2,2-tricarbonitrile
Smiles: N#CC1(C#N)C(c2ccc(cc2)OC)C(C)C2(C(C1(C#N)C(=O)N2)C)N

STK677087
Synonyms: diethyl4,6-dioxo-2-phenylcyclohexane-1,3-dicarboxylate
Smiles: CCOC(=O)C1C(=O)CC(=O)C(C1c1ccccc1)C(=O)OCC

STK677090
Synonyms: 3,3'-[(6-phenylpyrimidine-2,4-diyl)disulfanediyl]dipropanoicacid
Smiles: OC(=O)CCSc1nc(SCCC(=O)O)nc(c1)c1ccccc1

STK677093
Synonyms: 2-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]-N-methylbutan-2-amine
Smiles: CCC(c1nnnn1c1ccc(cc1)Cl)(NC)C

STK677099
Synonyms: 2-(4-aminophenyl)-6-methyl-1,3-benzothiazole-7-sulfonicacid
Smiles: Nc1ccc(cc1)c1nc2c(s1)c(c(cc2)C)S(=O)(=O)O

STK764222
Synonyms: [6-(1,3-benzodioxol-5-yl)-4-methyl-1,5,2-dioxazinan-2-yl](phenyl)methanone
Smiles: CC1CN(OC(O1)c1ccc2c(c1)OCO2)C(=O)c1ccccc1

STK764226
Synonyms: N-[4-(acetylamino)phenyl]-1-[4-(butan-2-yl)phenyl]-5-oxopyrrolidine-3-carboxamide
Smiles: CCC(c1ccc(cc1)N1CC(CC1=O)C(=O)Nc1ccc(cc1)NC(=O)C)C

STK764227
Synonyms: 3-(4-chlorophenyl)-2-(1-phenylethyl)-2,3-dihydroquinazolin-4(1H)-one
Smiles: Clc1ccc(cc1)N1C(Nc2c(C1=O)cccc2)C(c1ccccc1)C

STK764239
Synonyms: 4-(2-chlorophenyl)-2-(methylsulfanyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: CSC1=C(C#N)C(C2=C(N1)CCCC2=O)c1ccccc1Cl

STK677104
Synonyms: 2-({4-[4-(benzyloxy)-3-methoxyphenyl]-3-cyano-6-oxo-1,4,5,6-tetrahydropyridin-2-yl}sulfanyl)-N-(4-bromophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)Br)NC(=O)CC1c1ccc(c(c1)OC)OCc1ccccc1

STK764241
Synonyms: methyl({4-[3-(benzyloxy)-4-methoxyphenyl]-3-cyano-6-oxo-1,4,5,6-tetrahydropyridin-2-yl}sulfanyl)acetate
Smiles: COC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccc(c(c1)OCc1ccccc1)OC

STK764249
Synonyms: 6-(4-chlorophenyl)-2-phenylpyridazine-3(2H)-thione
Smiles: Clc1ccc(cc1)c1ccc(=S)n(n1)c1ccccc1

STK677107
Synonyms: 2-(methyl{[3-(piperidin-1-ylsulfonyl)phenyl]carbonyl}amino)benzoicacid
Smiles: O=C(N(c1ccccc1C(=O)O)C)c1cccc(c1)S(=O)(=O)N1CCCCC1

STK677109
Synonyms: [(4-{[(5-methylfuran-2-yl)carbonyl]amino}phenyl)amino](oxo)aceticacid
Smiles: O=C(c1ccc(o1)C)Nc1ccc(cc1)NC(=O)C(=O)O

STK764259
Synonyms: 1,3-dimethyl-5-(3-nitrophenyl)-5,6-dihydropyrimido[4,5-b][1,5]benzoxazepine-2,4(1H,3H)-dione
Smiles: O=c1c2C(Nc3c(Oc2n(c(=O)n1C)C)cccc3)c1cccc(c1)[N+](=O)[O-]

STK764260
Synonyms: 5-[4-(3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrobenzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: S=C1NC(=O)C(=Cc2ccc(c(c2)[N+](=O)[O-])N2CCc3c(C2)cccc3)C(=O)N1

STK764273
Synonyms: propyl4-(5-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-1H-tetrazol-1-yl)benzoate
Smiles: CCCOC(=O)c1ccc(cc1)n1nnnc1SCC(=O)N1CCCCC1

STK764276
Synonyms: (2E)-2-(1,3-benzothiazol-2-yl)-3-(3-methoxyphenyl)prop-2-enenitrile
Smiles: COc1cccc(c1)/C=C(/c1nc2c(s1)cccc2)\C#N

STK764293
Synonyms: 8-[4-hydroxy-2-methyl-5-(propan-2-yl)phenyl]-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cc1cc(O)c(cc1n1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccccc1)C(C)C

STK764294
Synonyms: 4-[5-(3-bromophenyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: Brc1cccc(c1)c1onc(n1)c1nonc1N

STK677124
Synonyms: 2-(4-methylphenyl)-2-oxoethyl4-(1H-tetrazol-1-yl)benzoate
Smiles: Cc1ccc(cc1)C(=O)COC(=O)c1ccc(cc1)n1cnnn1

STK764301
Synonyms: 5-(1,3-benzodioxol-5-yl)-1-(4-fluorophenyl)-3-hydroxy-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Fc1ccc(cc1)N1C(c2ccc3c(c2)OCO3)C(=C(C1=O)O)C(=O)c1ccccc1

STK764304
Synonyms: 6-[3-acetyl-2-(4-chlorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]hexanoicacid
Smiles: OC(=O)CCCCCN1C(c2ccc(cc2)Cl)C(=C(C1=O)O)C(=O)C

STK677127
Synonyms: 3-nitro-4-[(pyridin-3-ylmethyl)amino]benzoicacid
Smiles: [O-][N+](=O)c1cc(ccc1NCc1cccnc1)C(=O)O

STK764308
Synonyms: (9Z)-9-(4-hydroxybenzylidene)-4-methyl-2H-furo[2,3-h]chromene-2,8(9H)-dione
Smiles: Oc1ccc(cc1)/C=C/1\C(=O)Oc2c1c1oc(=O)cc(c1cc2)C

STK677132
Synonyms: 2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)hexanamide
Smiles: CCCCC(N1C(=O)C2C(C1=O)C1CC2C=C1)C(=O)N

STK764321
Synonyms: 2-amino-6-(4-methylphenyl)-4-(thiophen-2-yl)pyridine-3-carbonitrile
Smiles: N#Cc1c(N)nc(cc1c1cccs1)c1ccc(cc1)C

STK677138
Synonyms: N-[(2-methyl-4,5,6,7-tetrahydro-1-benzofuran-3-yl)carbonyl]methionine
Smiles: CSCCC(C(=O)O)NC(=O)c1c(C)oc2c1CCCC2

STK677141
Synonyms: N,N',N''-tris(2,2,2-trinitroethyl)-1,3,5-triazine-2,4,6-triamine
Smiles: [O-][N+](=O)C([N+](=O)[O-])([N+](=O)[O-])CNc1nc(NCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])nc(n1)NCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]

STK677143
Synonyms: 3-{[(5-methyl-2,1,3-benzothiadiazol-4-yl)sulfonyl]amino}benzoicacid
Smiles: Cc1ccc2c(c1S(=O)(=O)Nc1cccc(c1)C(=O)O)nsn2

STK677144
Synonyms: 2-{[(5-methyl-2,1,3-benzothiadiazol-4-yl)sulfonyl]amino}benzoicacid
Smiles: OC(=O)c1ccccc1NS(=O)(=O)c1c(C)ccc2c1nsn2

STK764332
Synonyms: 4-(4-bromophenyl)-8-tert-butyl-2-methyl-1-thia-4-azaspiro[4.5]decan-3-one
Smiles: CC1SC2(N(C1=O)c1ccc(cc1)Br)CCC(CC2)C(C)(C)C

STK677147
Synonyms: 2-methyl-4-phenyl-1,2,4-triazaspiro[4.5]decane-3-thione
Smiles: CN1NC2(N(C1=S)c1ccccc1)CCCCC2

STK677148
Synonyms: 3-[2-chloro-5-(trifluoromethyl)phenyl]-2-methylquinazolin-4(3H)-one
Smiles: Clc1ccc(cc1n1c(C)nc2c(c1=O)cccc2)C(F)(F)F

STK677150
Synonyms: 3-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-methylquinazolin-4(3H)-one
Smiles: Cc1nc2ccccc2c(=O)n1c1ccc2c(c1)OC(O2)(F)F

STK677152
Synonyms: 3-(carbamimidoylsulfanyl)propanoicacid
Smiles: OC(=O)CCSC(=N)N

STK764342
Synonyms: N-(2,6-dimethylphenyl)-4,6-dimethoxy-1,3,5-triazin-2-amine
Smiles: COc1nc(nc(n1)OC)Nc1c(C)cccc1C

STK764344
Synonyms: (2,4-diphenyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)(4-methylphenyl)methanone
Smiles: Cc1ccc(cc1)C(=O)N1C(CC(=Nc2c1cccc2)c1ccccc1)c1ccccc1

STK677156
Synonyms: 4-acetyl-5-(1,3-benzodioxol-5-yl)-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1ccc2c(c1)OCO2)CCN1CCOCC1

STK764347
Synonyms: N,N'-hexane-1,6-diylbis[2-(thiophen-2-yl)acetamide]
Smiles: O=C(Cc1cccs1)NCCCCCCNC(=O)Cc1cccs1

STK764348
Synonyms: ethyl2-methyl-5-oxo-1-phenyl-4-(phenylamino)-2,5-dihydro-1H-pyrrole-2-carboxylate
Smiles: CCOC(=O)C1(C)C=C(C(=O)N1c1ccccc1)Nc1ccccc1

STK764349
Synonyms: ethyl6-bromo-2-[(dimethylamino)methyl]-5-hydroxy-1-methyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c(CN(C)C)n(c2c1cc(O)c(c2)Br)C

STK764351
Synonyms: 5-(2-fluorophenyl)-1-phenyl-3-(phenylamino)-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C1C(=CC(N1c1ccccc1)c1ccccc1F)Nc1ccccc1

STK764353
Synonyms: 1,1'-{4-[(4-bromophenyl)amino]-6-hydroxy-6-methyl-2-[4-(propan-2-yl)phenyl]cyclohex-3-ene-1,3-diyl}diethanone
Smiles: CC(=O)C1C(c2ccc(cc2)C(C)C)C(=C(CC1(C)O)Nc1ccc(cc1)Br)C(=O)C

STK677158
Synonyms: (1Z)-2-bromo-N-hydroxy-1-(4-methyl-1,2,5-oxadiazol-3-yl)ethanimine
Smiles: Cc1nonc1/C(=N/O)/CBr

STK764362
Synonyms: 7-(3,5-dimethyl-1,2-oxazol-4-yl)-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole
Smiles: Cc1onc(c1n1nc2c(n1)c1nonc1cc2)C

STK764364
Synonyms: 1,5-diphenyl-1,2-dihydro-3H-1,2,4-triazole-3-thione
Smiles: S=c1nc(n([nH]1)c1ccccc1)c1ccccc1

STK764366
Synonyms: 4-(5-amino-1,3,4-oxadiazol-2-yl)-1,2,5-oxadiazol-3-amine
Smiles: Nc1nnc(o1)c1nonc1N

STK764369
Synonyms: butyl2-oxo-6-(piperidin-1-ylsulfonyl)-1,3-benzoxazole-3(2H)-carboxylate
Smiles: CCCCOC(=O)n1c(=O)oc2c1ccc(c2)S(=O)(=O)N1CCCCC1

STK764372
Synonyms: phenyl2-(ethylsulfanyl)-1H-benzimidazole-1-carboxylate
Smiles: CCSc1nc2c(n1C(=O)Oc1ccccc1)cccc2

STK764374
Synonyms: N-cyclohexyl-2-oxo-6-(piperidin-1-ylsulfonyl)-1,3-benzoxazole-3(2H)-carboxamide
Smiles: O=C(n1c(=O)oc2c1ccc(c2)S(=O)(=O)N1CCCCC1)NC1CCCCC1

STK677168
Synonyms: 2-chloro-4-{5-[(Z)-(5-cyano-2-hydroxy-4-methyl-6-oxopyridin-3(6H)-ylidene)methyl]furan-2-yl}benzoicacid
Smiles: N#CC1=C(C)/C(=C/c2ccc(o2)c2ccc(c(c2)Cl)C(=O)O)/C(=NC1=O)O

STK677179
Synonyms: 3-chloro-4-[(2,6-dimethylmorpholin-4-yl)methyl]benzonitrile
Smiles: N#Cc1ccc(c(c1)Cl)CN1CC(C)OC(C1)C

STK764405
Synonyms: 5,5'-oxybis[2-(pyrimidin-2-yl)-1H-isoindole-1,3(2H)-dione]
Smiles: O=C1c2cc(ccc2C(=O)N1c1ncccn1)Oc1ccc2c(c1)C(=O)N(C2=O)c1ncccn1

STK764410
Synonyms: 6-(4-bromophenyl)-2-phenyl-4H-1,3-dioxin-4-one
Smiles: O=C1C=C(OC(O1)c1ccccc1)c1ccc(cc1)Br

STK764411
Synonyms: 1,1'-piperazine-1,4-diylbis(2-hydroxy-2,2-diphenylethanone)
Smiles: O=C(C(c1ccccc1)(c1ccccc1)O)N1CCN(CC1)C(=O)C(c1ccccc1)(c1ccccc1)O

STK764416
Synonyms: [2-chloro-5-fluoro-4-(morpholin-4-yl)phenyl](3,4-dimethylphenyl)methanone
Smiles: Clc1cc(N2CCOCC2)c(cc1C(=O)c1ccc(c(c1)C)C)F

STK764419
Synonyms: [4-fluoro-5-(morpholin-4-yl)-2-nitrophenyl](morpholin-4-yl)methanone
Smiles: O=C(c1cc(N2CCOCC2)c(cc1[N+](=O)[O-])F)N1CCOCC1

STK764427
Synonyms: 1-[3-fluoro-4-(4-methylpiperidin-1-yl)phenyl]propan-1-one
Smiles: CCC(=O)c1ccc(c(c1)F)N1CCC(CC1)C

STK764448
Synonyms: 1,2,2,4-tetramethyl-1,2-dihydrobenzo[f]isoquinoline
Smiles: CC1c2c(ccc3c2cccc3)C(=NC1(C)C)C

STK764450
Synonyms: 4-hydroxy-4,5-dimethyl-5-(4-methylpent-3-en-1-yl)-1,3-oxazolidin-2-one
Smiles: CC(=CCCC1(C)OC(=O)NC1(C)O)C

STK677190
Synonyms: 2-[(1H-pyrazol-3-ylcarbonyl)amino]benzoicacid
Smiles: O=C(c1cc[nH]n1)Nc1ccccc1C(=O)O

STK764456
Synonyms: N-benzyl-1H-pyrazole-5-carboxamide
Smiles: O=C(c1ccn[nH]1)NCc1ccccc1

STK764457
Synonyms: N-benzyl-4-nitro-1H-pyrazole-5-carboxamide
Smiles: O=C(c1[nH]ncc1[N+](=O)[O-])NCc1ccccc1

STK764459
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-1H-pyrazole-5-carboxamide
Smiles: COc1cc(CCNC(=O)c2ccn[nH]2)ccc1OC

STK764460
Synonyms: N-(2-hydroxyethyl)-1H-pyrazole-5-carboxamide
Smiles: OCCNC(=O)c1ccn[nH]1

STK764461
Synonyms: 2-benzyl-4-hydrazinyl-6-nitro-1,2-benzothiazol-3(2H)-one1-oxide
Smiles: NNc1cc(cc2c1c(=O)n(s2=O)Cc1ccccc1)[N+](=O)[O-]

STK764462
Synonyms: ethyl4-amino-2-thioxo-3-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(=S)n(c1N)c1cccc(c1)C(F)(F)F

STK764463
Synonyms: ethyl4-amino-3-(2,5-dimethoxyphenyl)-2-thioxo-2,3-dihydro-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(=S)n(c1N)c1cc(OC)ccc1OC

STK677191
Synonyms: methyl5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxylate
Smiles: COC(=O)c1cnn2c1nc(C)cc2C

STK764468
Synonyms: 4-[5-(2-ethoxyphenyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: CCOc1ccccc1c1onc(n1)c1nonc1N

STK764470
Synonyms: 4-{5-[(2-bromo-4-chlorophenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1,2,5-oxadiazol-3-amine
Smiles: Clc1ccc(c(c1)Br)OCc1onc(n1)c1nonc1N

STK677193
Synonyms: 7-tert-butyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine
Smiles: Nc1ncnc2c1c1CCC(Cc1s2)C(C)(C)C

STK764471
Synonyms: 7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine
Smiles: CC1CCc2c(C1)sc1c2c(N)ncn1

STK764472
Synonyms: 4,4'-(1,2,4-oxadiazole-3,5-diyl)bis(1,2,5-oxadiazol-3-amine)
Smiles: Nc1nonc1c1onc(n1)c1nonc1N

STK677196
Synonyms: 3-methyl-1-(2-phenylethyl)piperidin-4-one
Smiles: O=C1CCN(CC1C)CCc1ccccc1

STK677197
Synonyms: 1-cyclohexyl-3-methylpiperidin-4-one
Smiles: O=C1CCN(CC1C)C1CCCCC1

STK677202
Synonyms: 5-amino-2-phenyl-2H-1,2,3-triazole-4-carboxamide
Smiles: NC(=O)c1nn(nc1N)c1ccccc1

STK677203
Synonyms: 2',2',3,6',6'-pentamethyl-1,4'-bipiperidin-4-one
Smiles: O=C1CCN(CC1C)C1CC(C)(C)NC(C1)(C)C

STK764478
Synonyms: 5-(furan-3-yl)-4-(prop-2-en-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: C=CCn1c(=S)[nH]nc1c1cocc1

STK764479
Synonyms: (8xi,9xi,10xi,13xi,14xi)-17,21-dihydroxypregn-4-ene-3,20-dione
Smiles: OCC(=O)[C@@]1(O)CCC2C1(C)CCC1C2CCC2=CC(=O)CCC12C

STK677204
Synonyms: 3-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-4-oxopentanoicacid
Smiles: OC(=O)CC(C1=C(O)CC(CC1=O)(C)C)C(=O)C

STK764480
Synonyms: 4-(prop-2-en-1-yl)-5-(thiophen-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: C=CCn1c(=S)[nH]nc1c1cscc1

STK677205
Synonyms: 4-hydroxy-4,5-dimethyl-5-(4-methylpent-3-en-1-yl)-3-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3-oxazolidin-2-one
Smiles: CC(=CCCC1(C)OC(=O)N(C1(C)O)C1CC(C)(C)NC(C1)(C)C)C

STK764481
Synonyms: 4-[5-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: Nc1nonc1c1noc(n1)C12CC3CC(C2)CC(C1)C3

STK764487
Synonyms: {4-[4-({4-[chloro(difluoro)methoxy]phenyl}amino)phthalazin-1-yl]phenyl}(morpholin-4-yl)methanone
Smiles: O=C(c1ccc(cc1)c1nnc(c2c1cccc2)Nc1ccc(cc1)OC(Cl)(F)F)N1CCOCC1

STK677207
Synonyms: (5-methyl-7-oxo-6-phenoxy-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)aceticacid
Smiles: OC(=O)Cc1nn2c(n1)[nH]c(c(c2=O)Oc1ccccc1)C

STK677208
Synonyms: 1-(4-tert-butylphenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc2c(cc1OC)CCNC2c1ccc(cc1)C(C)(C)C

STK764488
Synonyms: 2-(1,3-dioxo-5-phenoxy-1,3-dihydro-2H-isoindol-2-yl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: N#Cc1c(sc2c1CCC(C2)C)N1C(=O)c2c(C1=O)ccc(c2)Oc1ccccc1

STK677210
Synonyms: 4-[5-(2-methyl-3-nitrophenyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: [O-][N+](=O)c1cccc(c1C)c1onc(n1)c1nonc1N

STK764489
Synonyms: 4-[5-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: COc1cc(OC)cc(c1)c1onc(n1)c1nonc1N

STK677211
Synonyms: N,N'-ethane-1,2-diylbis(1H-pyrazole-5-carboxamide)
Smiles: O=C(c1ccn[nH]1)NCCNC(=O)c1ccn[nH]1

STK677213
Synonyms: 5-amino-2-phenyl-2H-1,2,3-triazole-4-carboxylicacid
Smiles: OC(=O)c1nn(nc1N)c1ccccc1

STK764494
Synonyms: N-benzyl-2-(2-methyl-4-nitro-1H-imidazol-1-yl)acetamide
Smiles: O=C(Cn1cc(nc1C)[N+](=O)[O-])NCc1ccccc1

STK764495
Synonyms: N-(3-hydroxypropyl)-2-(2-methyl-4-nitro-1H-imidazol-1-yl)acetamide
Smiles: [O-][N+](=O)c1cn(c(n1)C)CC(=O)NCCCO

STK764496
Synonyms: N-(4-methoxybenzyl)-2-(2-methyl-4-nitro-1H-imidazol-1-yl)acetamide
Smiles: COc1ccc(cc1)CNC(=O)Cn1cc(nc1C)[N+](=O)[O-]

STK764497
Synonyms: 5-amino-2-(4-methoxyphenyl)-2H-1,2,3-triazole-4-carboxamide
Smiles: COc1ccc(cc1)n1nc(c(n1)N)C(=O)N

STK677214
Synonyms: 5-amino-1-benzyl-N-[3-(diethylamino)propyl]-1H-1,2,3-triazole-4-carboxamide
Smiles: CCN(CCCNC(=O)c1nnn(c1N)Cc1ccccc1)CC

STK764505
Synonyms: dimethyl4-oxo-2,6-diphenylcyclohexane-1,1-dicarboxylate
Smiles: COC(=O)C1(C(=O)OC)C(CC(=O)CC1c1ccccc1)c1ccccc1

STK764506
Synonyms: 4-[5-(2,4-dichlorophenyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: Clc1ccc(c(c1)Cl)c1onc(n1)c1nonc1N

STK764507
Synonyms: 4-[5-(4-bromophenyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: Brc1ccc(cc1)c1onc(n1)c1nonc1N

STK764519
Synonyms: 4-[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: COc1ccc(cc1)c1onc(n1)c1nonc1N

STK764520
Synonyms: 4-[5-(2-nitrophenyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: [O-][N+](=O)c1ccccc1c1onc(n1)c1nonc1N

STK764521
Synonyms: 4-(5-{4-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}-1,2,4-oxadiazol-3-yl)-1,2,5-oxadiazol-3-amine
Smiles: Nc1nonc1c1noc(n1)c1ccc(cc1)Cn1nc(c(c1C)Cl)C

STK677217
Synonyms: {4-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]phenoxy}aceticacid
Smiles: OC(=O)COc1ccc(cc1)NS(=O)(=O)c1cccc2c1nsn2

STK677218
Synonyms: 4-[5-(5-chloro-2-methoxyphenyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: COc1ccc(cc1c1onc(n1)c1nonc1N)Cl

STK764522
Synonyms: 1-ethoxy-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Smiles: CCOc1cc(cc2c1C(=O)Nc1c(O2)cccc1)[N+](=O)[O-]

STK764523
Synonyms: 4,6-dinitro-2-phenyl-1,2-benzothiazol-3(2H)-one1-oxide
Smiles: [O-][N+](=O)c1cc(cc2c1c(=O)n(s2=O)c1ccccc1)[N+](=O)[O-]

STK764526
Synonyms: 2-benzyl-6-nitro-1,2-benzothiazol-3(2H)-one1,1-dioxide
Smiles: O=C1c2ccc(cc2S(=O)(=O)N1Cc1ccccc1)[N+](=O)[O-]

STK677221
Synonyms: 3-[2-(1,2-dimethyl-1H-indol-3-yl)ethyl]-4-methylidene-1-oxa-3-azaspiro[4.5]decan-2-one
Smiles: O=C1OC2(C(=C)N1CCc1c(C)n(c3c1cccc3)C)CCCCC2

STK677226
Synonyms: 3-{[3-(ethoxycarbonyl)-6-methoxyquinolin-4-yl]amino}benzoicacid
Smiles: CCOC(=O)c1cnc2c(c1Nc1cccc(c1)C(=O)O)cc(cc2)OC

STK764531
Synonyms: 3-(2,4-dichlorophenyl)-1H-pyrazol-5-ol
Smiles: Clc1ccc(c(c1)Cl)c1n[nH]c(c1)O

STK764537
Synonyms: 2-ethoxy-4-formylphenyl2-methylpropanoate
Smiles: CCOc1cc(C=O)ccc1OC(=O)C(C)C

STK764541
Synonyms: 3-iodo-4-[(4-iodobenzyl)oxy]-5-methoxybenzaldehyde
Smiles: O=Cc1cc(I)c(c(c1)OC)OCc1ccc(cc1)I

STK764543
Synonyms: 4-{[1-(3-chlorophenyl)-1H-tetrazol-5-yl]sulfanyl}butanenitrile
Smiles: N#CCCCSc1nnnn1c1cccc(c1)Cl

STK764546
Synonyms: 7-(naphthalen-1-yl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Smiles: c1ccc(cc1)C1=CC(n2c(N1)ncn2)c1cccc2c1cccc2

STK677230
Synonyms: 3-{5-[(3-methylbut-2-en-1-yl)sulfanyl]-1,3,4-oxadiazol-2-yl}pyridine
Smiles: CC(=CCSc1nnc(o1)c1cccnc1)C

STK677235
Synonyms: 2-(prop-2-en-1-ylsulfanyl)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Smiles: C=CCSc1nn2c(s1)nc1c(c2=O)cccc1

STK677239
Synonyms: 2-({[(Z)-amino(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino}oxy)acetamide
Smiles: NC(=O)CO/N=C(/c1nonc1N)\N

STK764551
Synonyms: (2Z)-2-{[1-(2-chloro-6-fluorobenzyl)-1H-indol-3-yl]methylidene}-1-benzothiophen-3(2H)-one
Smiles: Fc1cccc(c1Cn1cc(c2c1cccc2)/C=C/1\Sc2c(C1=O)cccc2)Cl

STK677240
Synonyms: 3-[5-(2-chlorophenyl)furan-2-yl]benzo[f]quinoline-1-carboxylicacid
Smiles: Clc1ccccc1c1ccc(o1)c1nc2ccc3c(c2c(c1)C(=O)O)cccc3

STK677241
Synonyms: 3-(3,5-di-tert-butyl-4-hydroxyphenyl)benzo[f]quinoline-1-carboxylicacid
Smiles: OC(=O)c1cc(nc2c1c1ccccc1cc2)c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C

STK677245
Synonyms: 6-tert-butyl-2-{[(2-methylphenoxy)acetyl]amino}-N-[2-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: O=C(Nc1sc2c(c1C(=O)Nc1ccccc1C(F)(F)F)CCC(C2)C(C)(C)C)COc1ccccc1C

STK764553
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: NNC(=O)c1nnn(c1c1ccc(cc1)C)c1nonc1N

STK677248
Synonyms: 2,7,7,9-tetramethyl-1,2,4-triazaspiro[4.5]decane-3-thione
Smiles: CC1CC(C)(C)CC2(C1)NC(=S)N(N2)C

STK677253
Synonyms: 1,2,2,5-tetramethylpiperidin-4-ol
Smiles: CC1CN(C)C(CC1O)(C)C

STK764558
Synonyms: 4-{3-hydroxy-5-(4-methoxyphenyl)-4-[(4-methylphenyl)carbonyl]-2-oxo-2,5-dihydro-1H-pyrrol-1-yl}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: COc1ccc(cc1)C1C(=C(C(=O)N1c1c(C)n(n(c1=O)c1ccccc1)C)O)C(=O)c1ccc(cc1)C

STK764559
Synonyms: methyl4-ethyl-2-({1,1,1,3,3,3-hexafluoro-2-[(furan-2-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)c1ccco1

STK677258
Synonyms: 2-({2-oxo-2-[(2-phenylethyl)amino]ethyl}sulfanyl)benzoicacid
Smiles: O=C(CSc1ccccc1C(=O)O)NCCc1ccccc1

STK764561
Synonyms: [6-(furan-2-yl)-4-(phenoxymethyl)-1,5,2-dioxazinan-2-yl](phenyl)methanone
Smiles: O=C(N1CC(COc2ccccc2)OC(O1)c1ccco1)c1ccccc1

STK764562
Synonyms: [6-(1H-indol-3-yl)-4-(phenoxymethyl)-1,5,2-dioxazinan-2-yl](phenyl)methanone
Smiles: O=C(N1CC(COc2ccccc2)OC(O1)c1c[nH]c2c1cccc2)c1ccccc1

STK677260
Synonyms: [6-(furan-3-yl)-4-(phenoxymethyl)-1,5,2-dioxazinan-2-yl](phenyl)methanone
Smiles: O=C(N1CC(COc2ccccc2)OC(O1)c1ccoc1)c1ccccc1

STK764564
Synonyms: [6-(3-hydroxyphenyl)-4-(phenoxymethyl)-1,5,2-dioxazinan-2-yl](phenyl)methanone
Smiles: Oc1cccc(c1)C1OC(COc2ccccc2)CN(O1)C(=O)c1ccccc1

STK764565
Synonyms: [6-(2-hydroxyphenyl)-4-(phenoxymethyl)-1,5,2-dioxazinan-2-yl](phenyl)methanone
Smiles: O=C(N1CC(COc2ccccc2)OC(O1)c1ccccc1O)c1ccccc1

STK764566
Synonyms: [6-(1,3-benzodioxol-5-yl)-4-(phenoxymethyl)-1,5,2-dioxazinan-2-yl](phenyl)methanone
Smiles: O=C(N1CC(COc2ccccc2)OC(O1)c1ccc2c(c1)OCO2)c1ccccc1

STK764568
Synonyms: 6-({2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-4-(furan-2-yl)-N-(2-methoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)Cl)C)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1OC)C

STK764569
Synonyms: ethyl4-phenyl-2-(trifluoromethyl)-2H-pyrido[1,2-a][1,3,5]triazine-2-carboxylate
Smiles: CCOC(=O)C1(N=c2ccccn2C(=N1)c1ccccc1)C(F)(F)F

STK677262
Synonyms: 5-(4-bromophenyl)-3-hydroxy-1-(morpholin-4-ylmethyl)-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Brc1ccc(cc1)C1N(CN2CCOCC2)C(=O)C(=C1C(=O)c1ccccc1)O

STK764592
Synonyms: 2-phenyl-6,7,8,9-tetrahydroimidazo[1,2-b][1,2,4]benzotriazine
Smiles: c1ccc(cc1)c1nc2n(c1)nc1c(n2)CCCC1

STK677266
Synonyms: (4-chloro-2,5-dimethoxyphenyl)hydrazine
Smiles: NNc1cc(OC)c(cc1OC)Cl

STK677267
Synonyms: (4-ethylphenyl)hydrazine
Smiles: CCc1ccc(cc1)NN

STK677268
Synonyms: 7-[2,4-di(morpholin-4-yl)-5-nitrophenyl]-3-thioxo-8-oxa-2,4-diazabicyclo[4.2.0]oct-1(6)-en-5-one
Smiles: [O-][N+](=O)c1cc(c(cc1N1CCOCC1)N1CCOCC1)C1Oc2c1c(=O)[nH]c(=S)[nH]2

STK677269
Synonyms: 3-amino-2-hydroxybenzoicacid
Smiles: OC(=O)c1cccc(c1O)N

STK764598
Synonyms: N-[2-(cyclopropylcarbonyl)-1-benzofuran-3-yl]-4-(trifluoromethyl)benzamide
Smiles: O=C(c1ccc(cc1)C(F)(F)F)Nc1c(oc2c1cccc2)C(=O)C1CC1

STK764602
Synonyms: [4-(4-bromophenyl)-2-phenyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl](phenyl)methanone
Smiles: Brc1ccc(cc1)C1=Nc2ccccc2N(C(C1)c1ccccc1)C(=O)c1ccccc1

STK677273
Synonyms: 5-bromo-6-hydroxy-1,3-benzoxathiol-2-one
Smiles: O=c1sc2c(o1)cc(c(c2)Br)O

STK677274
Synonyms: 4-[bis(thiophen-2-ylmethyl)amino]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N(Cc1cccs1)Cc1cccs1

STK764604
Synonyms: 5-cyano-6-({2-[(2-ethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(furan-2-yl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2CC)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1)C

STK764605
Synonyms: 5-cyano-6-({2-[(2,4-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(furan-2-yl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2C)C)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1)C

STK764607
Synonyms: 5-cyano-N-(2-methoxyphenyl)-2-methyl-6-{[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl}-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2nccs2)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1OC)C

STK764609
Synonyms: 6-({2-[(3-chloro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-4-(furan-2-yl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2C)Cl)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1)C

STK764610
Synonyms: 5-cyano-6-({2-[(3,4-dichlorophenyl)amino]-2-oxoethyl}sulfanyl)-4-(furan-2-yl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)Cl)Cl)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1)C

STK677276
Synonyms: 2-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(Cc2nc3n(c2)c(C)ccc3)C(=O)c2c1cccc2

STK764612
Synonyms: ethyl5-[(1H-benzimidazol-2-ylsulfanyl)methyl]-3-ethyl-2-oxotetrahydrofuran-3-carboxylate(non-preferredname)
Smiles: CCOC(=O)C1(CC)CC(OC1=O)CSc1nc2c([nH]1)cccc2

STK764615
Synonyms: N-(2-acetyl-1-benzofuran-3-yl)-4-(trifluoromethyl)benzamide
Smiles: O=C(c1ccc(cc1)C(F)(F)F)Nc1c(oc2c1cccc2)C(=O)C

STK764617
Synonyms: [3-amino-6-phenyl-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl](piperidin-1-yl)methanone
Smiles: O=C(c1sc2c(c1N)c(cc(n2)c1ccccc1)C(F)(F)F)N1CCCCC1

STK764618
Synonyms: (3-amino-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridin-2-yl)(morpholin-4-yl)methanone
Smiles: O=C(c1sc2c(c1N)cc1c(n2)CCCCC1)N1CCOCC1

STK677283
Synonyms: 3-azido-4-(methoxymethyl)-6-methyl-N,N-diphenylthieno[2,3-b]pyridine-2-carboxamide
Smiles: COCc1cc(C)nc2c1c(N=[N+]=[N-])c(s2)C(=O)N(c1ccccc1)c1ccccc1

STK677284
Synonyms: 3-[(chloroacetyl)amino]-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridine-2-carboxamide
Smiles: COCc1cc(C)nc2c1c(NC(=O)CCl)c(s2)C(=O)N

STK764647
Synonyms: (1E)-1-(3,4-dimethoxybenzylidene)-6-methylfuro[3,4-c]pyridine-3,4(1H,5H)-dione
Smiles: COc1cc(ccc1OC)/C=C\1/OC(=O)c2c1cc(C)[nH]c2=O

STK764648
Synonyms: 1-(furan-2-ylmethyl)-7-methylpyrido[3,4-d]pyridazine-4,5(3H,6H)-dione
Smiles: Cc1[nH]c(=O)c2c(c1)c(n[nH]c2=O)Cc1ccco1

STK677288
Synonyms: 3,6-diamino-2,5-dinitropentalene-3a,6a(1H,4H)-dicarbonitrile
Smiles: N#CC12CC(=C(C2(C#N)CC(=C1N)[N+](=O)[O-])N)[N+](=O)[O-]

STK677289
Synonyms: 2,4,6-trichloro-N-(4-methoxyphenyl)-5-nitropyridine-3-carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1c(Cl)nc(c(c1Cl)[N+](=O)[O-])Cl

STK764656
Synonyms: 3-[2-(5-chloro-2-methyl-1H-indol-3-yl)ethyl]-4-hydroxy-4,5,5-trimethyl-1,3-oxazolidin-2-one
Smiles: O=C1OC(C(N1CCc1c(C)[nH]c2c1cc(Cl)cc2)(C)O)(C)C

STK764658
Synonyms: methylpyrazolo[1,5-a]pyrimidine-3-carboxylate
Smiles: COC(=O)c1cnn2c1nccc2

STK677296
Synonyms: 2-(6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)propan-2-ol
Smiles: COc1cc2c(cc1OC)CCNC2(C)C(O)(C)C

STK677297
Synonyms: 3-[2-(5,7-dichloro-2-methyl-1H-indol-3-yl)ethyl]-4-hydroxy-4,5,5-trimethyl-1,3-oxazolidin-2-one
Smiles: Clc1cc(Cl)c2c(c1)c(CCN1C(=O)OC(C1(C)O)(C)C)c([nH]2)C

STK764661
Synonyms: N-(4-chlorophenyl)-2-{[3-cyano-4-(4-ethoxy-3-methoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1OC)C1CC(=O)NC(=C1C#N)SCC(=O)Nc1ccc(cc1)Cl

STK764662
Synonyms: 2-{[3-cyano-4-(4-methylphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(3,5-dichlorophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(Cl)cc(c2)Cl)NC(=O)CC1c1ccc(cc1)C

STK764663
Synonyms: 2-{[3-cyano-4-(4-methylphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)C)NC(=O)CC1c1ccc(cc1)C

STK764664
Synonyms: methyl4-(4-chlorophenyl)-5-cyano-2-oxo-6-{[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl}-1,2,3,4-tetrahydropyridine-3-carboxylate
Smiles: COC(=O)C1C(=O)NC(=C(C1c1ccc(cc1)Cl)C#N)SCC(=O)Nc1nccs1

STK764665
Synonyms: tert-butyl4-(4-chlorophenyl)-5-cyano-2-methyl-6-({2-[(4-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,4-dihydropyridine-3-carboxylate
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)C)NC(=C(C1c1ccc(cc1)Cl)C(=O)OC(C)(C)C)C

STK764666
Synonyms: tert-butyl4-(4-chlorophenyl)-5-cyano-2-methyl-6-{[2-(naphthalen-2-ylamino)-2-oxoethyl]sulfanyl}-1,4-dihydropyridine-3-carboxylate
Smiles: N#CC1=C(SCC(=O)Nc2ccc3c(c2)cccc3)NC(=C(C1c1ccc(cc1)Cl)C(=O)OC(C)(C)C)C

STK677302
Synonyms: 6-({2-[(4-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-4-(2-ethoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: CCOc1ccccc1C1C(=C(SCC(=O)Nc2ccc(cc2)Cl)NC(=C1C(=O)Nc1ccccc1)C)C#N

STK677303
Synonyms: 5-cyano-4-(2-ethoxyphenyl)-6-({2-[(4-ethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: CCOc1ccccc1C1C(=C(SCC(=O)Nc2ccc(cc2)OCC)NC(=C1C(=O)Nc1ccccc1)C)C#N

STK677304
Synonyms: 5-cyano-6-({2-[(2,4-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(2-ethoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: CCOc1ccccc1C1C(=C(SCC(=O)Nc2ccc(cc2C)C)NC(=C1C(=O)Nc1ccccc1)C)C#N

STK764667
Synonyms: 5-cyano-4-(2-ethoxyphenyl)-2-methyl-6-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: CCOc1ccccc1C1C(=C(SCC(=O)c2ccc(cc2)C)NC(=C1C(=O)Nc1ccccc1)C)C#N

STK764668
Synonyms: 5-cyano-4-(2-ethoxyphenyl)-2-methyl-6-({2-[(4-methylphenyl)amino]-2-oxoethyl}sulfanyl)-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: CCOc1ccccc1C1C(=C(SCC(=O)Nc2ccc(cc2)C)NC(=C1C(=O)Nc1ccccc1)C)C#N

STK677305
Synonyms: 5-cyano-6-({2-[(2,5-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(2-ethoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: CCOc1ccccc1C1C(=C(SCC(=O)Nc2cc(C)ccc2C)NC(=C1C(=O)Nc1ccccc1)C)C#N

STK764670
Synonyms: 6-({2-[(4-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-methyl-N-phenyl-1,4-dihydro-4,4'-bipyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)Cl)NC(=C(C1c1ccncc1)C(=O)Nc1ccccc1)C

STK764671
Synonyms: 5-cyano-2-methyl-6-{[2-(naphthalen-2-ylamino)-2-oxoethyl]sulfanyl}-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc3c(c2)cccc3)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1)C

STK677306
Synonyms: 6-({2-[(3-butoxyphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-methyl-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide
Smiles: CCCCOc1cccc(c1)NC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1)c1ccccc1

STK764672
Synonyms: 6-({2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-methyl-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)Cl)C)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1)C

STK764674
Synonyms: 5-cyano-6-({2-[(4-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)F)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1)C

STK764675
Synonyms: 5-cyano-6-({2-[(3,5-dichlorophenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(Cl)cc(c2)Cl)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1)C

STK677307
Synonyms: 6-({2-[(4-chloro-2,5-dimethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-methyl-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(OC)c(cc2OC)Cl)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1)C

STK677308
Synonyms: 6-({2-[(3-bromophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-methyl-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)Br)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1)C

STK677309
Synonyms: 5-cyano-2-methyl-6-({2-oxo-2-[(4-phenoxyphenyl)amino]ethyl}sulfanyl)-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)Oc2ccccc2)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1)C

STK677310
Synonyms: 6-({2-[(4-butoxyphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-methyl-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide
Smiles: CCCCOc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1)c1ccccc1

STK764676
Synonyms: 5-cyano-2-methyl-N-(2-methylphenyl)-6-({2-[(2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2C)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1C)C

STK764677
Synonyms: 5-cyano-6-({2-[(2,4-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-N-(2-methylphenyl)-4-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2C)C)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1C)C

STK764678
Synonyms: 5-cyano-6-({2-[(2,5-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-N-(2-methylphenyl)-4-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(C)ccc2C)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1C)C

STK677311
Synonyms: 5-cyano-6-({2-[(3,5-dichlorophenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-N-(2-methylphenyl)-4-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(Cl)cc(c2)Cl)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1C)C

STK764680
Synonyms: 6-({2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-methyl-N-(2-methylphenyl)-4-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)Cl)C)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1C)C

STK764681
Synonyms: ethyl({3-cyano-6-methyl-5-[(2-methylphenyl)carbamoyl]-4-phenyl-1,4-dihydropyridin-2-yl}sulfanyl)acetate
Smiles: CCOC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1C)c1ccccc1

STK764682
Synonyms: butyl({3-cyano-6-methyl-5-[(2-methylphenyl)carbamoyl]-4-phenyl-1,4-dihydropyridin-2-yl}sulfanyl)acetate
Smiles: CCCCOC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1C)c1ccccc1

STK677312
Synonyms: N-(4-chlorophenyl)-5-cyano-6-({2-[(4-iodophenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)I)NC(=C(C1c1ccccc1)C(=O)Nc1ccc(cc1)Cl)C

STK677313
Synonyms: N-(4-chlorophenyl)-5-cyano-2-methyl-6-{[2-(naphthalen-2-ylamino)-2-oxoethyl]sulfanyl}-4-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc3c(c2)cccc3)NC(=C(C1c1ccccc1)C(=O)Nc1ccc(cc1)Cl)C

STK677314
Synonyms: 6-({2-[(3-chloro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-N-(4-chlorophenyl)-5-cyano-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2C)Cl)NC(=C(C1c1ccccc1)C(=O)Nc1ccc(cc1)Cl)C

STK677315
Synonyms: 6-({2-[(4-bromophenyl)amino]-2-oxoethyl}sulfanyl)-N-(4-chlorophenyl)-5-cyano-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)Br)NC(=C(C1c1ccccc1)C(=O)Nc1ccc(cc1)Cl)C

STK764683
Synonyms: N-(4-chlorophenyl)-5-cyano-2-methyl-6-({2-[(2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2C)NC(=C(C1c1ccccc1)C(=O)Nc1ccc(cc1)Cl)C

STK764684
Synonyms: N-(4-chlorophenyl)-5-cyano-6-({2-[(4-ethylphenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)CC)NC(=C(C1c1ccccc1)C(=O)Nc1ccc(cc1)Cl)C

STK764685
Synonyms: N-(4-chlorophenyl)-6-({2-[(4-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)Cl)NC(=C(C1c1ccccc1)C(=O)Nc1ccc(cc1)Cl)C

STK764686
Synonyms: 5-cyano-4-(furan-2-yl)-N-(2-methoxyphenyl)-2-methyl-6-({2-[(3-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)C)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1OC)C

STK764688
Synonyms: 5-cyano-4-(furan-2-yl)-N-(2-methoxyphenyl)-6-({2-[(3-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-1,4-dihydropyridine-3-carboxamide
Smiles: COc1cccc(c1)NC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1OC)c1ccco1

STK764689
Synonyms: 5-cyano-6-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-4-(furan-2-yl)-N-(2-methoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)c2ccc(cc2)F)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1OC)C

STK764690
Synonyms: 5-cyano-4-(furan-2-yl)-N-(2-methoxyphenyl)-2-methyl-6-({2-[(4-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)C)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1OC)C

STK677316
Synonyms: N-[(1Z)-3-(2-chlorophenyl)-2-cyano-1-({2-[(2,5-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-5-oxo-5-phenylpent-1-en-1-yl]benzamide
Smiles: N#C/C(=C(/NC(=O)c1ccccc1)\SCC(=O)Nc1cc(C)ccc1C)/C(c1ccccc1Cl)CC(=O)c1ccccc1

STK677317
Synonyms: N-[(1Z)-3-(2-chlorophenyl)-2-cyano-1-({2-[(2,4-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-5-oxo-5-phenylpent-1-en-1-yl]benzamide
Smiles: N#C/C(=C(/NC(=O)c1ccccc1)\SCC(=O)Nc1ccc(cc1C)C)/C(c1ccccc1Cl)CC(=O)c1ccccc1

STK764691
Synonyms: 5-cyano-4-(furan-2-yl)-2-methyl-N-(2-methylphenyl)-6-{[2-(naphthalen-2-ylamino)-2-oxoethyl]sulfanyl}-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc3c(c2)cccc3)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1C)C

STK764692
Synonyms: 6-({2-[(4-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-4-(furan-2-yl)-2-methyl-N-(2-methylphenyl)-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)Cl)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1C)C

STK764693
Synonyms: 6-({2-[(3-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-4-(furan-2-yl)-2-methyl-N-(2-methylphenyl)-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)Cl)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1C)C

STK764694
Synonyms: 6-({2-[(3-chloro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-4-(furan-2-yl)-2-methyl-N-(2-methylphenyl)-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2C)Cl)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1C)C

STK764695
Synonyms: 5-cyano-6-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-4-(furan-2-yl)-2-methyl-N-(2-methylphenyl)-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)c2ccc(cc2)F)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1C)C

STK764696
Synonyms: 5-cyano-6-({2-[(4-ethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4-(furan-2-yl)-2-methyl-N-(2-methylphenyl)-1,4-dihydropyridine-3-carboxamide
Smiles: CCOc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1C)c1ccco1

STK764697
Synonyms: 5-cyano-4-(furan-2-yl)-2-methyl-N-(2-methylphenyl)-6-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)c2ccc(cc2)C)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1C)C

STK764698
Synonyms: benzyl({3-cyano-4-(furan-2-yl)-6-methyl-5-[(2-methylphenyl)carbamoyl]-1,4-dihydropyridin-2-yl}sulfanyl)acetate
Smiles: N#CC1=C(SCC(=O)OCc2ccccc2)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1C)C

STK764700
Synonyms: 5-cyano-2-methyl-6-({2-[(4-methylphenyl)amino]-2-oxoethyl}sulfanyl)-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)C)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1)C

STK764701
Synonyms: 6-(butylsulfanyl)-5-cyano-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Smiles: CCCCSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1)c1cccs1

STK764702
Synonyms: N-(3-chloro-2-methylphenyl)-2-{[3-cyano-7,7-dimethyl-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2C)Cl)NC2=C(C1c1cccs1)C(=O)CC(C2)(C)C

STK764703
Synonyms: 2-{[3-cyano-7,7-dimethyl-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(2,4-dimethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2C)C)NC2=C(C1c1cccs1)C(=O)CC(C2)(C)C

STK764704
Synonyms: propyl({5-[(4-chlorophenyl)carbamoyl]-3-cyano-4-(furan-2-yl)-6-methyl-1,4-dihydropyridin-2-yl}sulfanyl)acetate
Smiles: CCCOC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccc(cc1)Cl)c1ccco1

STK764705
Synonyms: N-(4-chlorophenyl)-5-cyano-4-(furan-2-yl)-2-methyl-6-({2-[(4-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)C)NC(=C(C1c1ccco1)C(=O)Nc1ccc(cc1)Cl)C

STK764706
Synonyms: N-(4-chlorophenyl)-6-({2-[(4-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)Cl)NC(=C(C1c1ccco1)C(=O)Nc1ccc(cc1)Cl)C

STK764707
Synonyms: 5-cyano-6-({2-[(2,3-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2C)C)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1)C

STK677322
Synonyms: 4-[(E)-(2-methoxyphenyl)diazenyl]-3-methyl-1H-pyrazol-5-ol
Smiles: COc1ccccc1/N=N/c1c(O)[nH]nc1C

STK764711
Synonyms: 4-methyl-4H-1,2,4-triazol-3-yl(1E)-2-oxo-N-phenylpropanehydrazonothioate
Smiles: CC(=O)/C(=N\Nc1ccccc1)/Sc1nncn1C

STK677323
Synonyms: N'-(1,3-benzodioxol-5-ylmethyl)-N,N-diethylbenzene-1,4-diamine
Smiles: CCN(c1ccc(cc1)NCc1ccc2c(c1)OCO2)CC

STK764713
Synonyms: N-(3-nitrophenyl)-4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
Smiles: [O-][N+](=O)c1cccc(c1)Nc1nc(OCC(F)(F)F)nc(n1)OCC(F)(F)F

STK764714
Synonyms: (2-{[4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-yl]amino}phenyl)(phenyl)methanone
Smiles: O=C(c1ccccc1Nc1nc(OCC(F)(F)F)nc(n1)OCC(F)(F)F)c1ccccc1

STK677329
Synonyms: 2-(3,4-dichlorophenyl)-5-methyl-1,3-thiazolidin-4-one
Smiles: O=C1NC(SC1C)c1ccc(c(c1)Cl)Cl

STK764718
Synonyms: 5-benzyl-6-hydroxy-3-(4-methoxyphenyl)-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}pyrimidin-4(3H)-one
Smiles: COc1ccc(cc1)n1c(SCC(=O)N2CCCCC2)nc(c(c1=O)Cc1ccccc1)O

STK764719
Synonyms: 2-{[5-benzyl-4-hydroxy-1-(4-methoxyphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-phenylacetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2)nc(c(c1=O)Cc1ccccc1)O

STK764721
Synonyms: 3,3'-ethane-1,2-diylbis(1H-1,2,4-triazol-5-amine)
Smiles: Nc1[nH]nc(n1)CCc1n[nH]c(n1)N

STK677332
Synonyms: 1-methyl-1H-1,2,4-triazol-5-amine
Smiles: Cn1ncnc1N

STK764723
Synonyms: methylN-(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)-beta-alaninate
Smiles: [O-][N+](=O)c1nc(n(n1)C)NCCC(=O)OC

STK764729
Synonyms: 5-bromo-6-[(3-hydroxypropyl)amino]pyrimidine-2,4(1H,3H)-dione
Smiles: OCCCNc1[nH]c(=O)[nH]c(=O)c1Br

STK764731
Synonyms: N-tert-butyl-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide
Smiles: O=C(Cn1cnc(n1)[N+](=O)[O-])NC(C)(C)C

STK677336
Synonyms: 3-(pyridin-4-yl)-1H-pyrazol-5-ol
Smiles: Oc1[nH]nc(c1)c1ccncc1

STK764734
Synonyms: 2-(iodoethynyl)tricyclo[3.3.1.1~3,7~]dec-2-ylacetate
Smiles: IC#CC1(OC(=O)C)C2CC3CC1CC(C2)C3

STK764736
Synonyms: 2-[(3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl)methyl]benzonitrile
Smiles: N#Cc1ccccc1Cn1c(=O)c2n(C)cnc2n(c1=O)C

STK764739
Synonyms: 2-[5-(2-chlorophenyl)-2H-tetrazol-2-yl]-N-(2,5-dimethylphenyl)acetamide
Smiles: Cc1ccc(c(c1)NC(=O)Cn1nnc(n1)c1ccccc1Cl)C

STK677338
Synonyms: N-{(Z)-{[(4-fluorobenzyl)oxy]imino}[4-(propanoylamino)-1,2,5-oxadiazol-3-yl]methyl}propanamide
Smiles: CCC(=O)N/C(=N\OCc1ccc(cc1)F)/c1nonc1NC(=O)CC

STK764740
Synonyms: 5-amino-1,4-dihydroquinoxaline-2,3-dione
Smiles: Nc1cccc2c1[nH]c(=O)c(=O)[nH]2

STK677339
Synonyms: dimethyl3,4-dihydroxythiophene-2,5-dicarboxylate
Smiles: COC(=O)c1sc(c(c1O)O)C(=O)OC

STK677340
Synonyms: [4-(1,3-benzoxazol-2-yl)piperazin-1-yl](cyclohexyl)methanone
Smiles: O=C(N1CCN(CC1)c1nc2c(o1)cccc2)C1CCCCC1

STK764747
Synonyms: 1-{1-[2-(4-chloro-2-methylphenoxy)ethyl]-5-hydroxy-2-methyl-1H-indol-3-yl}ethanone
Smiles: Clc1ccc(c(c1)C)OCCn1c(C)c(c2c1ccc(c2)O)C(=O)C

STK677347
Synonyms: 1'-[(4-benzylpiperazin-1-yl)methyl]-5-(hydroxymethyl)-5-nitrospiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one
Smiles: OCC1(COC2(OC1)C(=O)N(c1c2cccc1)CN1CCN(CC1)Cc1ccccc1)[N+](=O)[O-]

STK677348
Synonyms: 3-nitro-4-(2,2,3,3-tetrafluoropropoxy)benzoicacid
Smiles: FC(C(COc1ccc(cc1[N+](=O)[O-])C(=O)O)(F)F)F

STK764750
Synonyms: ethyl5-({[(5-tert-butyl-2-methylfuran-3-yl)carbonyl]amino}methyl)furan-2-carboxylate
Smiles: CCOC(=O)c1ccc(o1)CNC(=O)c1cc(oc1C)C(C)(C)C

STK677351
Synonyms: 5-({[(4-carboxyfuran-3-yl)carbonyl]amino}methyl)furan-2-carboxylicacid
Smiles: O=C(c1cocc1C(=O)O)NCc1ccc(o1)C(=O)O

STK677355
Synonyms: N-[(1E)-1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl]-N~2~-formyl-2-methylalaninamide
Smiles: O=CNC(C(=O)NC(C(C)(C)C)/C=C/c1ccc(cc1Cl)Cl)(C)C

STK764754
Synonyms: 3-(3-methoxyphenyl)-1,7,9-trimethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: COc1cccc(c1)C1=NN(C)c2n(C1)c1c(=O)n(C)c(=O)n(c1n2)C

STK764757
Synonyms: 7-(3-methoxyphenyl)-1,3-dimethyl-8-(3-methylphenyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1cccc(c1)c1cn2c(n1c1cccc(c1)C)nc1c2c(=O)n(C)c(=O)n1C

STK764760
Synonyms: 7-(3-methoxyphenyl)-1,3-dimethyl-8-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1cccc(c1)c1cn2c(n1c1ccccc1)nc1c2c(=O)n(C)c(=O)n1C

STK764764
Synonyms: 8-hydrazinyl-7-(2-hydroxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCn1c(NN)nc2c1c(=O)n(C)c(=O)n2C

STK764765
Synonyms: 8-[(2E)-2-(2-hydroxybenzylidene)hydrazinyl]-7-(2-hydroxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCn1c(N/N=C/c2ccccc2O)nc2c1c(=O)n(c(=O)n2C)C

STK677357
Synonyms: 2-(3-methoxyphenyl)imidazo[1,2-a]pyridin-8-amine
Smiles: COc1cccc(c1)c1cn2c(n1)c(N)ccc2

STK677358
Synonyms: 2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1H-isoindole-1,3(2H)-dione
Smiles: Cc1ccc2n(c1)cc(n2)CN1C(=O)c2c(C1=O)cccc2

STK764776
Synonyms: 2-hydroxy-2,2-bis(3-methylphenyl)-N-(piperidin-1-yl)acetamide
Smiles: Cc1cccc(c1)C(c1cccc(c1)C)(C(=O)NN1CCCCC1)O

STK764779
Synonyms: 2,2-bis(4-fluorophenyl)-2-hydroxy-N-methyl-N',N'-diphenylacetohydrazide
Smiles: Fc1ccc(cc1)C(C(=O)N(N(c1ccccc1)c1ccccc1)C)(c1ccc(cc1)F)O

STK764781
Synonyms: 2-(5-hydroxynonan-5-yl)-4-(4-methylphenyl)-6,6-diphenyl-4H-1,3,4-oxadiazin-5(6H)-one
Smiles: CCCCC(C1=NN(c2ccc(cc2)C)C(=O)C(O1)(c1ccccc1)c1ccccc1)(CCCC)O

STK764798
Synonyms: 2-[(E)-2-(1H-indol-3-yl)ethenyl]-3-methylquinazolin-4(3H)-one
Smiles: Cn1c(/C=C/c2c[nH]c3c2cccc3)nc2c(c1=O)cccc2

STK764799
Synonyms: 3-methyl-2-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]quinazolin-4(3H)-one
Smiles: Cn1c(/C=C/c2cn(c3c2cccc3)C)nc2c(c1=O)cccc2

STK764806
Synonyms: 1-(4-ethoxyphenyl)-3-(morpholin-4-yl)propan-1-one
Smiles: CCOc1ccc(cc1)C(=O)CCN1CCOCC1

STK764807
Synonyms: 1-(4-fluorophenyl)-3-(morpholin-4-yl)propan-1-one
Smiles: O=C(c1ccc(cc1)F)CCN1CCOCC1

STK764809
Synonyms: 1-(4-chlorophenyl)-3-(morpholin-4-yl)propan-1-one
Smiles: O=C(c1ccc(cc1)Cl)CCN1CCOCC1

STK764810
Synonyms: 1-(4-butoxyphenyl)-3-(morpholin-4-yl)propan-1-one
Smiles: CCCCOc1ccc(cc1)C(=O)CCN1CCOCC1

STK677365
Synonyms: 1-(morpholin-4-yl)-2-phenyl-3-(4-propoxyphenyl)pentan-3-ol
Smiles: CCCOc1ccc(cc1)C(C(c1ccccc1)CN1CCOCC1)(CC)O

STK677367
Synonyms: 2-[(5-thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl)carbamoyl]benzoicacid
Smiles: O=C(c1ccccc1C(=O)O)Nc1n[nH]c(=S)s1

STK764815
Synonyms: 8-methyl-4-[3-(trifluoromethyl)phenyl]-1-thia-4-azaspiro[4.5]decan-3-one
Smiles: CC1CCC2(CC1)SCC(=O)N2c1cccc(c1)C(F)(F)F

STK764818
Synonyms: 2-(1,3-benzothiazol-2-yl)-8-tert-butyl-1,2,4-triazaspiro[4.5]decane-3-thione
Smiles: S=C1NC2(NN1c1nc3c(s1)cccc3)CCC(CC2)C(C)(C)C

STK677372
Synonyms: ethyl2-(aminomethyl)-5-tert-butylfuran-3-carboxylate
Smiles: CCOC(=O)c1cc(oc1CN)C(C)(C)C

STK677374
Synonyms: ethyl3-(aminomethyl)furan-2-carboxylate
Smiles: CCOC(=O)c1occc1CN

STK677378
Synonyms: 5-oxo-3-phenyl-5-(1H-tetrazol-5-ylamino)pentanoicacid
Smiles: O=C(Nc1nnn[nH]1)CC(c1ccccc1)CC(=O)O

STK764829
Synonyms: 9-[4-(methylsulfanyl)phenyl]-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Smiles: CSc1ccc(cc1)C1C2=C(CCCC2=O)OC2=C1C(=O)CCC2

STK764831
Synonyms: 5,5,6-trimethyl-3-[phenyl(phenylamino)methyl]bicyclo[2.2.1]heptan-2-one
Smiles: O=C1C2CC(C1C(c1ccccc1)Nc1ccccc1)C(C2C)(C)C

STK677383
Synonyms: N-[7-hydroxy-5-(methoxymethyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]propanamide
Smiles: COCc1cc(O)n2c(n1)nc(n2)NC(=O)CC

STK677384
Synonyms: 3-(4-tert-butylphenyl)benzo[f]quinoline-1-carboxylicacid
Smiles: OC(=O)c1cc(nc2c1c1ccccc1cc2)c1ccc(cc1)C(C)(C)C

STK677386
Synonyms: 1-[4,5-dicyano-6-imino-9-(4-methoxyphenyl)-3-oxo-10-(propan-2-yl)-2,7-diazatricyclo[3.2.2.1~1,4~]dec-7-yl]urea
Smiles: N#CC12C(CC3(N(C1=N)NC(=O)N)C(C2(C#N)C(=O)N3)C(C)C)c1ccc(cc1)OC

STK764851
Synonyms: 5-chloro-2-{[(3,4-dimethoxyphenyl)carbonyl]amino}-N-(furan-2-ylmethyl)benzamide
Smiles: COc1cc(ccc1OC)C(=O)Nc1ccc(cc1C(=O)NCc1ccco1)Cl

STK764854
Synonyms: N-{4-chloro-2-[(2,6-dimethylmorpholin-4-yl)carbonyl]phenyl}-3,4-dimethoxybenzamide
Smiles: COc1ccc(cc1OC)C(=O)Nc1ccc(cc1C(=O)N1CC(C)OC(C1)C)Cl

STK764855
Synonyms: 2-(4-chlorophenyl)-3,3,5-trimethyl-6-oxo-3,6-dihydro-2H-pyran-4-ylbenzoate
Smiles: Clc1ccc(cc1)C1OC(=O)C(=C(C1(C)C)OC(=O)c1ccccc1)C

STK764857
Synonyms: 2-(3,4-dimethoxyphenyl)-3,3,5-trimethyl-6-oxo-3,6-dihydro-2H-pyran-4-ylbenzoate
Smiles: COc1cc(ccc1OC)C1OC(=O)C(=C(C1(C)C)OC(=O)c1ccccc1)C

STK677390
Synonyms: N-(2,4-dichlorophenyl)-6,7-dimethoxy-3,3-dimethyl-3,4-dihydroisoquinolin-1-amine
Smiles: COc1cc2C(=NC(Cc2cc1OC)(C)C)Nc1ccc(cc1Cl)Cl

STK677392
Synonyms: 3-hydroxy-5-phenyl-4-(phenylcarbonyl)-1-[2-(piperazin-1-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C1C(=C(C(N1CCN1CCNCC1)c1ccccc1)C(=O)c1ccccc1)O

STK764877
Synonyms: 2-[4-(trifluoromethyl)phenyl]-4H-[1]benzofuro[3,2-d][1,3]oxazin-4-one
Smiles: O=c1oc(nc2c1oc1c2cccc1)c1ccc(cc1)C(F)(F)F

STK764880
Synonyms: 3-amino-N-(5-phenyl-1,3,4-thiadiazol-2-yl)-6-(thiophen-2-yl)-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: O=C(c1sc2c(c1N)c(cc(n2)c1cccs1)C(F)(F)F)Nc1nnc(s1)c1ccccc1

STK764892
Synonyms: (2,6-difluorophenyl)(pyrrolidin-1-yl)methanone
Smiles: O=C(c1c(F)cccc1F)N1CCCC1

STK764894
Synonyms: 1-(4-{4-[(2-chloro-4,5-difluorophenyl)carbonyl]piperazin-1-yl}-3-fluorophenyl)butan-1-one
Smiles: CCCC(=O)c1ccc(c(c1)F)N1CCN(CC1)C(=O)c1cc(F)c(cc1Cl)F

STK764899
Synonyms: [4-(2-fluoro-4-nitrophenyl)piperazin-1-yl](3-fluorophenyl)methanone
Smiles: Fc1cccc(c1)C(=O)N1CCN(CC1)c1ccc(cc1F)[N+](=O)[O-]

STK764905
Synonyms: ethyl3,3,3-trifluoro-2-(pentanoylamino)-N-1,3-thiazol-2-ylalaninate
Smiles: CCCCC(=O)NC(C(F)(F)F)(C(=O)OCC)Nc1nccs1

STK764906
Synonyms: ethyl3,3,3-trifluoro-N-(4-methylpyridin-2-yl)-2-(pentanoylamino)alaninate
Smiles: CCCCC(=O)NC(C(F)(F)F)(C(=O)OCC)Nc1nccc(c1)C

STK764910
Synonyms: ethyl2-[(1-benzofuran-2-ylcarbonyl)amino]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(nc1C)NC(=O)c1cc2c(o1)cccc2

STK764922
Synonyms: 4-(morpholin-4-yl)-6-(2,2,2-trifluoroethoxy)-N-[4-(trifluoromethoxy)phenyl]-1,3,5-triazin-2-amine
Smiles: FC(COc1nc(Nc2ccc(cc2)OC(F)(F)F)nc(n1)N1CCOCC1)(F)F

STK764925
Synonyms: 2-(2-methoxyphenyl)-4,6-dinitro-2H-indazole
Smiles: COc1ccccc1n1nc2c(c1)c(cc(c2)[N+](=O)[O-])[N+](=O)[O-]

STK764926
Synonyms: 5-amino-3-(4-methoxyphenyl)-7-oxo-4-propyl-6-azabicyclo[3.2.1]octane-1,2,2-tricarbonitrile
Smiles: CCCC1C(c2ccc(cc2)OC)C(C#N)(C#N)C2(CC1(N)NC2=O)C#N

STK764928
Synonyms: 5-(4-methoxyphenyl)-3-methylcyclohex-2-en-1-one
Smiles: COc1ccc(cc1)C1CC(=CC(=O)C1)C

STK677409
Synonyms: 1-(2-aminoethyl)-3-hydroxy-4-(methylsulfonyl)-5-phenyl-1,5-dihydro-2H-pyrrol-2-one
Smiles: NCCN1C(=O)C(=C(C1c1ccccc1)S(=O)(=O)C)O

STK677410
Synonyms: 3-({4-[chloro(difluoro)methoxy]phenyl}carbamoyl)-1,2,2-trimethylcyclopentanecarboxylicacid
Smiles: O=C(C1CCC(C1(C)C)(C)C(=O)O)Nc1ccc(cc1)OC(Cl)(F)F

STK764936
Synonyms: methylN-acetyl-2-({4-[chloro(difluoro)methoxy]phenyl}amino)-3,3,3-trifluoroalaninate
Smiles: COC(=O)C(C(F)(F)F)(Nc1ccc(cc1)OC(Cl)(F)F)NC(=O)C

STK764937
Synonyms: methyl2-({4-[chloro(difluoro)methoxy]phenyl}amino)-3,3,3-trifluoro-N-propanoylalaninate
Smiles: COC(=O)C(C(F)(F)F)(Nc1ccc(cc1)OC(Cl)(F)F)NC(=O)CC

STK764942
Synonyms: 2-amino-4-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]-5-oxo-7-phenyl-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Smiles: N#CC1=C(N)OC2=C(C1c1c[nH]nc1c1ccc(cc1)F)C(=O)CC(C2)c1ccccc1

STK764943
Synonyms: 6-amino-3-tert-butyl-4-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1c[nH]nc1c1ccc(cc1)F)c(n[nH]2)C(C)(C)C

STK764949
Synonyms: 3-(furan-2-yl)-4,4-dimethyl-2-oxaspiro[5.5]undecane-1,5-dione
Smiles: O=C1OC(c2ccco2)C(C(=O)C21CCCCC2)(C)C

STK764950
Synonyms: 3-(3,4-dimethoxyphenyl)-4,4-dimethyl-2-oxaspiro[5.5]undecane-1,5-dione
Smiles: COc1ccc(cc1OC)C1OC(=O)C2(C(=O)C1(C)C)CCCCC2

STK764955
Synonyms: 2-(4-chlorophenyl)-1,3-dioxan-5-yl4-(hexyloxy)benzoate
Smiles: CCCCCCOc1ccc(cc1)C(=O)OC1COC(OC1)c1ccc(cc1)Cl

STK764956
Synonyms: 2-hydroxy-N-(piperidin-1-yl)-2,2-di(thiophen-3-yl)acetamide
Smiles: O=C(C(c1cscc1)(c1cscc1)O)NN1CCCCC1

STK677415
Synonyms: 3-(dimethylamino)-N'-{hydroxy[bis(4-methylphenyl)]acetyl}-N-phenylpropanehydrazide(non-preferredname)
Smiles: CN(CCC(=O)N(c1ccccc1)NC(=O)C(c1ccc(cc1)C)(c1ccc(cc1)C)O)C

STK764967
Synonyms: 2-benzyl-2-hydroxy-3-phenyl-N'-(1-phenylpropan-2-yl)propanehydrazide
Smiles: CC(Cc1ccccc1)NNC(=O)C(Cc1ccccc1)(Cc1ccccc1)O

STK764968
Synonyms: 4-[3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)prop-2-yn-1-yl]morpholine
Smiles: O1CCN(CC1)CC#CC12CC3CC(C2)CC(C1)C3

STK764973
Synonyms: 3,3,5,5-tetramethyl-6-(2-nitrophenyl)dihydro-2H-pyran-2,4(3H)-dione
Smiles: [O-][N+](=O)c1ccccc1C1OC(=O)C(C(=O)C1(C)C)(C)C

STK764974
Synonyms: 3-{2-[(4-chlorophenyl)amino]-1,3-thiazol-4-yl}-6-methoxy-2H-chromen-2-one
Smiles: COc1ccc2c(c1)cc(c(=O)o2)c1csc(n1)Nc1ccc(cc1)Cl

STK764976
Synonyms: ethyl5-methyl-1-(4-phenyl-1,2,5-oxadiazol-3-yl)-1H-1,2,3-triazole-4-carboxylate
Smiles: CCOC(=O)c1nnn(c1C)c1nonc1c1ccccc1

STK764981
Synonyms: 3,3'-(1-oxopropane-1,3-diyl)bis(6-bromo-1,3-benzoxazol-2(3H)-one)
Smiles: Brc1ccc2c(c1)oc(=O)n2CCC(=O)n1c(=O)oc2c1ccc(c2)Br

STK764989
Synonyms: 4-chloro-N-(4-methoxyphenyl)-6-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-amine
Smiles: COc1ccc(cc1)Nc1nc(Cl)nc(n1)N1CCN(CC1)c1ccc(cc1)OC

STK764994
Synonyms: 3-[4,6-di(morpholin-4-yl)-1,3,5-triazin-2-yl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: O=c1cccc2n1CC1CN(CC2C1)c1nc(nc(n1)N1CCOCC1)N1CCOCC1

STK764996
Synonyms: 3-(4-ethoxyphenyl)-1H-pyrazol-5-ol
Smiles: CCOc1ccc(cc1)c1n[nH]c(c1)O

STK677423
Synonyms: N-[1-(1H-indol-3-yl)propan-2-yl]imidodicarbonimidicdiamide
Smiles: CC(Cc1c[nH]c2c1cccc2)NC(=N)NC(=N)N

STK677424
Synonyms: (5Z)-3-(4-carboxybenzyl)-5-[(phenylcarbamoyl)imino]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide
Smiles: O=C(Nc1ccccc1)/N=C/1\ON=[N+]([CH-]1)Cc1ccc(cc1)C(=O)O

STK677425
Synonyms: (5E)-3-(2-phenylethyl)-5-{[(3,4,5-trimethoxyphenyl)carbonyl]imino}-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide
Smiles: COc1cc(cc(c1OC)OC)C(=O)/N=C\1/ON=[N+]([CH-]1)CCc1ccccc1

STK765004
Synonyms: ethyl2-{[(1-benzyl-3-nitro-1H-pyrazol-5-yl)carbonyl]amino}-4,5-dimethylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(sc(c1C)C)NC(=O)c1cc(nn1Cc1ccccc1)[N+](=O)[O-]

STK765025
Synonyms: methyl2-{[(2,4-difluorophenoxy)acetyl]amino}-4,5-dimethylthiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)COc2ccc(cc2F)F)sc(c1C)C

STK765027
Synonyms: ethyl2-{[(4-chlorophenyl)carbonyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccc(cc2)Cl)sc2c1CCC(C2)C

STK765030
Synonyms: ethyl6-ethyl-2-{[(3-methoxyphenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cccc(c2)OC)sc2c1CCC(C2)CC

STK765032
Synonyms: methyl2-{[(1-benzyl-3-nitro-1H-pyrazol-5-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)c2cc(nn2Cc2ccccc2)[N+](=O)[O-])sc2c1CCCC2

STK765044
Synonyms: ethyl2-{[(1-benzyl-3-nitro-1H-pyrazol-5-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc(nn2Cc2ccccc2)[N+](=O)[O-])sc2c1CCCC2

STK677429
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-1-benzyl-3-nitro-1H-pyrazole-5-carboxamide
Smiles: O=C(c1cc(nn1Cc1ccccc1)[N+](=O)[O-])NCc1ccc2c(c1)OCO2

STK677432
Synonyms: 1-[2-(dimethylamino)ethyl]-1H-indole-2-carbonitrile
Smiles: N#Cc1cc2c(n1CCN(C)C)cccc2

STK677433
Synonyms: 1-[2-(dimethylamino)ethyl]-N-phenyl-1H-indole-2-carboxamide
Smiles: CN(CCn1c(cc2c1cccc2)C(=O)Nc1ccccc1)C

STK765077
Synonyms: ethyl6-ethyl-2-{[(4-fluorophenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccc(cc2)F)sc2c1CCC(C2)CC

STK765079
Synonyms: ethyl2-{[(4-chlorophenoxy)acetyl]amino}-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)COc2ccc(cc2)Cl)sc2c1CCC(C2)CC

STK765088
Synonyms: propan-2-yl2-{[(1-benzyl-3-nitro-1H-pyrazol-5-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CC(OC(=O)c1c(NC(=O)c2cc(nn2Cc2ccccc2)[N+](=O)[O-])sc2c1CCCC2)C

STK677434
Synonyms: 2-(cyclohexylamino)-2-oxoethyl(9-oxoacridin-10(9H)-yl)acetate
Smiles: O=C(NC1CCCCC1)COC(=O)Cn1c2ccccc2c(=O)c2c1cccc2

STK765093
Synonyms: N',3-dihydroxy-4-methoxybenzenecarboximidamide
Smiles: O/N=C(/c1ccc(c(c1)O)OC)\N

STK677437
Synonyms: N-[4-chloro-2-(phenylcarbonyl)phenyl]-2-{[3-cyano-6-phenyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2C(=O)c2ccccc2)Cl)nc(cc1C(F)(F)F)c1ccccc1

STK765100
Synonyms: 6H,11H-isochromeno[4,3-c]chromene-6,11-dione
Smiles: O=c1oc2c(c3c1cccc3)c(=O)oc1c2cccc1

STK765101
Synonyms: ethyl1-[2-(4-ethylphenoxy)ethyl]-5-hydroxy-2-methyl-1H-benzo[g]indole-3-carboxylate
Smiles: CCOC(=O)c1c2cc(O)c3c(c2n(c1C)CCOc1ccc(cc1)CC)cccc3

STK765103
Synonyms: N-[5-oxo-2-(thiophen-2-yl)-5H-chromeno[4,3-d]pyrimidin-4-yl]propanamide
Smiles: CCC(=O)Nc1nc(nc2c1c(=O)oc1c2cccc1)c1cccs1

STK677446
Synonyms: 3-(2-hydroxyphenyl)-1-methyl-4,6-dioxo-5-phenyloctahydropyrrolo[3,4-c]pyrrole-1-carboxylicacid
Smiles: O=C1N(c2ccccc2)C(=O)C2C1C(NC2(C)C(=O)O)c1ccccc1O

STK677447
Synonyms: 5-benzyl-3-(2,4-dihydroxyphenyl)-1-(2-methylpropyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylicacid
Smiles: CC(CC1(NC(C2C1C(=O)N(C2=O)Cc1ccccc1)c1ccc(cc1O)O)C(=O)O)C

STK765110
Synonyms: 1,2-bis(2-fluorobenzyl)-4-phenyl-1,2,4-triazolidine-3,5-dione
Smiles: Fc1ccccc1Cn1c(=O)n(c(=O)n1Cc1ccccc1F)c1ccccc1

STK765111
Synonyms: methyl(4,6-dinitro-3-oxo-1,2-benzothiazol-2(3H)-yl)acetate
Smiles: COC(=O)Cn1sc2c(c1=O)c(cc(c2)[N+](=O)[O-])[N+](=O)[O-]

STK765113
Synonyms: 3-(4-amino-5-fluoro-2-oxopyrimidin-1(2H)-yl)propanenitrile
Smiles: Nc1nc(=O)n(cc1F)CCC#N

STK677453
Synonyms: 3-(6-oxo-8-sulfanyl-1,6-dihydro-9H-purin-9-yl)propanenitrile
Smiles: N#CCCn1c(S)nc2c1nc[nH]c2=O

STK677455
Synonyms: 3,5-dinitro-N-phenyl-2-[(E)-(2-phenylhydrazinylidene)methyl]aniline
Smiles: [O-][N+](=O)c1cc(cc(c1/C=N/Nc1ccccc1)Nc1ccccc1)[N+](=O)[O-]

STK765120
Synonyms: methyl(4,6-dinitro-1-oxido-3-oxo-1,2-benzothiazol-2(3H)-yl)acetate
Smiles: COC(=O)Cn1c(=O)c2c(s1=O)cc(cc2[N+](=O)[O-])[N+](=O)[O-]

STK765121
Synonyms: 2-(4-methoxyphenyl)-4,6-dinitro-2H-indazole
Smiles: COc1ccc(cc1)n1nc2c(c1)c(cc(c2)[N+](=O)[O-])[N+](=O)[O-]

STK765122
Synonyms: 1-(4-methoxyphenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Smiles: COc1ccc(cc1)Oc1cc(cc2c1C(=O)Nc1c(O2)cccc1)[N+](=O)[O-]

STK677456
Synonyms: 3,3'-ethane-1,2-diylbis(4-hydroxy-4,7,7,9,9-pentamethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one)
Smiles: O=C1OC2(C(N1CCN1C(=O)OC3(C1(C)O)CC(C)(C)NC(C3)(C)C)(C)O)CC(C)(C)NC(C2)(C)C

STK677457
Synonyms: 1,3-dimethyl-1H-indolo[3,2-g]pteridine-2,4(3H,10H)-dione
Smiles: Cn1c2nc3[nH]c4c(c3nc2c(=O)n(c1=O)C)cccc4

STK765125
Synonyms: N-(3-bromophenyl)-4-(trifluoromethyl)benzamide
Smiles: Brc1cccc(c1)NC(=O)c1ccc(cc1)C(F)(F)F

STK765126
Synonyms: (4-phenylpiperazin-1-yl)[4-(trifluoromethyl)phenyl]methanone
Smiles: O=C(c1ccc(cc1)C(F)(F)F)N1CCN(CC1)c1ccccc1

STK677458
Synonyms: [2-amino-3-cyano-7-(furan-2-yl)-2',5-dioxo-5,6,7,8-tetrahydrospiro[chromene-4,3'-indol]-1'(2'H)-yl]aceticacid
Smiles: N#CC1=C(N)OC2=C(C31C(=O)N(c1c3cccc1)CC(=O)O)C(=O)CC(C2)c1ccco1

STK677459
Synonyms: 2-[4-(2-hydroxyethyl)piperazin-1-yl]-1-[2-(trifluoromethyl)-10H-phenothiazin-10-yl]ethanone
Smiles: OCCN1CCN(CC1)CC(=O)N1c2ccccc2Sc2c1cc(cc2)C(F)(F)F

STK677461
Synonyms: N-(1,3-thiazol-2-yl)-4-(trifluoromethyl)benzamide
Smiles: O=C(c1ccc(cc1)C(F)(F)F)Nc1nccs1

STK765131
Synonyms: 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-[(5R,10S,13S,17S)-2',2',10,13-tetramethylhexadecahydro-3'H-spiro[cyclopenta[a]phenanthrene-17,5'-[1,3]oxazolidin]-3'-yl]ethanone
Smiles: O=C(N1C[C@]2(OC1(C)C)CCC1[C@]2(C)CCC2C1CC[C@@H]1[C@]2(C)CCCC1)CSC1=NCCN1

STK765140
Synonyms: 2,6-di-tert-butyl-4-{[4-(4-methylphenyl)phthalazin-1-yl]sulfanyl}phenol
Smiles: Cc1ccc(cc1)c1nnc(c2c1cccc2)Sc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C

STK677465
Synonyms: 4-{5-[(2-chlorophenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1,2,5-oxadiazol-3-amine
Smiles: Clc1ccccc1OCc1onc(n1)c1nonc1N

STK765152
Synonyms: 2-chloro-5-nitrophenyl2,3,3,3-tetrafluoro-2-methoxypropanoate
Smiles: COC(C(F)(F)F)(C(=O)Oc1cc(ccc1Cl)[N+](=O)[O-])F

STK765155
Synonyms: 2-{2-[2-(diphenylphosphoryl)phenoxy]ethyl}-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(CCOc2ccccc2P(=O)(c2ccccc2)c2ccccc2)C(=O)c2c1cccc2

STK765171
Synonyms: 7-(4-{[(2-chlorophenyl)carbonyl]carbamothioyl}piperazin-1-yl)-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C(=S)NC(=O)c1ccccc1Cl)c(c2)F

STK765173
Synonyms: 3-(3-chlorophenyl)-1-[4-(dimethylamino)benzyl]-1-(furan-2-ylmethyl)thiourea
Smiles: Clc1cccc(c1)NC(=S)N(Cc1ccco1)Cc1ccc(cc1)N(C)C

STK765180
Synonyms: 2-(3-fluorobenzyl)-5-(4-fluorophenyl)-2H-tetrazole
Smiles: Fc1ccc(cc1)c1nnn(n1)Cc1cccc(c1)F

STK677480
Synonyms: 3-(3-bromophenyl)benzo[f]quinoline-1-carboxylicacid
Smiles: Brc1cccc(c1)c1nc2ccc3c(c2c(c1)C(=O)O)cccc3

STK677482
Synonyms: N-(4-methyl-1,2,5-oxadiazol-3-yl)thiophene-2-carboxamide
Smiles: O=C(c1cccs1)Nc1nonc1C

STK677485
Synonyms: methyl2-(2-carbamoylaziridin-1-yl)-2-methylpropanoate
Smiles: COC(=O)C(N1CC1C(=O)N)(C)C

STK677486
Synonyms: 1-acetyl-4-(acetylamino)-1H-pyrazole-3-carboxylicacid
Smiles: CC(=O)Nc1cn(nc1C(=O)O)C(=O)C

STK765189
Synonyms: N-(4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)acetamide
Smiles: CC(=O)Nc1c(C)cc([nH]c1=O)C

STK677487
Synonyms: 1-[(4aS,9bR)-2,8-dimethyl-1,2,3,4,4a,9b-hexahydro-5H-pyrido[4,3-b]indol-5-yl]-2-(piperidin-1-yl)ethanone
Smiles: CN1CC[C@H]2[C@@H](C1)c1cc(C)ccc1N2C(=O)CN1CCCCC1

STK677488
Synonyms: 2-(3-{[(3-iodo-1-methyl-1H-pyrazol-5-yl)carbonyl]oxy}phenyl)-1,3-thiazolidine-4-carboxylicacid
Smiles: OC(=O)C1CSC(N1)c1cccc(c1)OC(=O)c1cc(nn1C)I

STK765196
Synonyms: 4-{5-[1-(3,4-dimethylphenoxy)ethyl]-1,2,4-oxadiazol-3-yl}-1,2,5-oxadiazol-3-amine
Smiles: CC(c1onc(n1)c1nonc1N)Oc1ccc(c(c1)C)C

STK677491
Synonyms: 4-[5-(thiophen-2-yl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: Nc1nonc1c1noc(n1)c1cccs1

STK765197
Synonyms: (5Z)-5-{[5-(3-chloro-4-methylphenyl)furan-2-yl]methylidene}-2-imino-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-4-one
Smiles: N=C1S/C(=C\c2ccc(o2)c2ccc(c(c2)Cl)C)/C(=O)N1c1nccs1

STK765200
Synonyms: 1-[1-(5-bromo-2-fluorophenyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl]-2-chloroethanone
Smiles: ClCC(=O)N1CCc2c(C1c1cc(Br)ccc1F)cc(c(c2)OC)OC

STK765204
Synonyms: 3-imino-1,7-dimethyl-5-(pyridin-4-yl)-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile
Smiles: N#CC12C(=N)OC(OC1c1ccncc1)(C(C2(C#N)C#N)C)C

STK677496
Synonyms: 4-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)benzoicacid
Smiles: COc1cc2c(cc1OC)CCNC2c1ccc(cc1)C(=O)O

STK765209
Synonyms: 4-{5-[(2,4-dichlorophenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1,2,5-oxadiazol-3-amine
Smiles: Clc1ccc(c(c1)Cl)OCc1onc(n1)c1nonc1N

STK765214
Synonyms: (1E)-1-(2,4-dichlorobenzylidene)-6-methylfuro[3,4-c]pyridine-3,4(1H,5H)-dione
Smiles: Clc1ccc(c(c1)Cl)/C=C\1/OC(=O)c2c1cc(C)[nH]c2=O

STK765218
Synonyms: ethyl2,4,6-trichloro-5-nitropyridine-3-carboxylate
Smiles: CCOC(=O)c1c(Cl)nc(c(c1Cl)[N+](=O)[O-])Cl

STK765219
Synonyms: N-butyl-2,4,6-trichloro-5-nitropyridine-3-carboxamide
Smiles: CCCCNC(=O)c1c(Cl)nc(c(c1Cl)[N+](=O)[O-])Cl

STK765222
Synonyms: N-(butylcarbamoyl)-2,6-dichloro-4-methylpyridine-3-carboxamide
Smiles: CCCCNC(=O)NC(=O)c1c(C)cc(nc1Cl)Cl

STK765223
Synonyms: 5-chloro-2-(4-fluorophenoxy)-4,6-dimethylpyridine-3-carboxamide
Smiles: Fc1ccc(cc1)Oc1nc(C)c(c(c1C(=O)N)C)Cl

STK765225
Synonyms: N-{3-[(3-cyano-4,6-dimethylpyridin-2-yl)oxy]phenyl}-3-methylbutanamide
Smiles: N#Cc1c(C)cc(nc1Oc1cccc(c1)NC(=O)CC(C)C)C

STK677503
Synonyms: 4-[5-(5-bromofuran-2-yl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: Brc1ccc(o1)c1onc(n1)c1nonc1N

STK765239
Synonyms: 4-{5-[(4-chlorophenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1,2,5-oxadiazol-3-amine
Smiles: Clc1ccc(cc1)OCc1onc(n1)c1nonc1N

STK677505
Synonyms: 2-chloro-6-methoxypyrimidine-4-carboxylicacid
Smiles: COc1nc(Cl)nc(c1)C(=O)O

STK765241
Synonyms: 2-(3-ethyl-2-imino-2,3-dihydro-1H-benzimidazol-1-yl)-1-(3-methoxyphenyl)ethanone
Smiles: COc1cccc(c1)C(=O)Cn1c(=N)n(c2c1cccc2)CC

STK677508
Synonyms: (2'-amino-3'-cyano-2,5'-dioxo-5'H-spiro[indole-3,4'-pyrano[3,2-c]chromen]-1(2H)-yl)aceticacid
Smiles: N#CC1=C(N)Oc2c(C31c1ccccc1N(C3=O)CC(=O)O)c(=O)oc1c2cccc1

STK677510
Synonyms: 1-(2-chloro-10H-phenothiazin-10-yl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone
Smiles: OCCN1CCN(CC1)CC(=O)N1c2ccccc2Sc2c1cc(Cl)cc2

STK765248
Synonyms: 3-phenyl-2-(phenylsulfonyl)-1,2,3,5,6,10b-hexahydroimidazo[5,1-a]isoquinoline
Smiles: O=S(=O)(N1CC2N(C1c1ccccc1)CCc1c2cccc1)c1ccccc1

STK765250
Synonyms: 4-[5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: COc1cc(ccc1OC)c1onc(n1)c1nonc1N

STK765252
Synonyms: 4-{5-[(3-methyl-4-nitrophenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1,2,5-oxadiazol-3-amine
Smiles: [O-][N+](=O)c1ccc(cc1C)OCc1onc(n1)c1nonc1N

STK677516
Synonyms: 2-{3-[3-(4-amino-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazol-5-yl]propyl}-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(CCCc2onc(n2)c2nonc2N)C(=O)c2c1cccc2

STK677518
Synonyms: 4-[2-amino-3-cyano-7-(furan-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl]-2-ethoxy-6-nitrophenylmorpholine-4-carboxylate
Smiles: CCOc1cc(cc(c1OC(=O)N1CCOCC1)[N+](=O)[O-])C1C(=C(N)OC2=C1C(=O)CC(C2)c1ccco1)C#N

STK765267
Synonyms: 2-amino-4'-bromo-7-(furan-2-yl)-5'-methyl-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[chromene-4,3'-indole]-3-carbonitrile
Smiles: N#CC1=C(N)OC2=C(C31C(=O)Nc1c3c(Br)c(cc1)C)C(=O)CC(C2)c1ccco1

STK677522
Synonyms: 4-{5-[1-(4-chloro-3-methylphenoxy)ethyl]-1,2,4-oxadiazol-3-yl}-1,2,5-oxadiazol-3-amine
Smiles: CC(c1onc(n1)c1nonc1N)Oc1ccc(c(c1)C)Cl

STK765280
Synonyms: 4-[5-(2-bromophenyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: Brc1ccccc1c1onc(n1)c1nonc1N

STK765283
Synonyms: 4,6-diazido-2-benzyl-1,2-benzothiazol-3(2H)-one1-oxide
Smiles: [N-]=[N+]=Nc1cc(N=[N+]=[N-])cc2c1c(=O)n(s2=O)Cc1ccccc1

STK765285
Synonyms: ethyl(2E)-6'H-spiro[cyclohexane-1,7'-[1,3]dioxolo[4,5-g]isoquinolin]-5'(8'H)-ylideneethanoate
Smiles: CCOC(=O)/C=C\1/NC2(CCCCC2)Cc2c1cc1OCOc1c2

STK677526
Synonyms: (2Z,5E)-5-(4-{[4-amino-6-(morpholin-4-yl)-1,3,5-triazin-2-yl]methoxy}-3-methoxybenzylidene)-3-(4-fluorophenyl)-2-[(4-fluorophenyl)imino]-1,3-thiazolidin-4-one
Smiles: COc1cc(ccc1OCc1nc(N)nc(n1)N1CCOCC1)/C=C\1/S/C(=N\c2ccc(cc2)F)/N(C1=O)c1ccc(cc1)F

STK765286
Synonyms: N-(2-phenylethyl)-2-{[1-(2,4,6-trimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}acetamide
Smiles: O=C(CSc1nnnn1c1c(C)cc(cc1C)C)NCCc1ccccc1

STK765288
Synonyms: 3-{[4-amino-6-(morpholin-4-yl)-1,3,5-triazin-2-yl]methyl}-1,3-benzoxazol-2(3H)-one
Smiles: Nc1nc(nc(n1)N1CCOCC1)Cn1c(=O)oc2c1cccc2

STK765298
Synonyms: N,N',N''-{[(2E)-3-(tetrazolo[1,5-a]pyrimidin-5-yl)triaz-2-en-1-ylidene]-lambda~5~-phosphanetriyl}tris(N-ethylethanamine)
Smiles: CCN(P(=N/N=N/c1ccn2c(n1)nnn2)(N(CC)CC)N(CC)CC)CC

STK677532
Synonyms: 3-(furan-2-ylmethyl)-4-hydroxy-4-methyl-1-oxa-3-azaspiro[4.5]decan-2-one
Smiles: O=C1OC2(C(N1Cc1ccco1)(C)O)CCCCC2

STK765306
Synonyms: (5E)-3-(4-amino-1,2,5-oxadiazol-3-yl)-2-imino-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-1,3-thiazolidin-4-one
Smiles: N=C1S/C(=C/c2ccc(o2)c2ccccc2[N+](=O)[O-])/C(=O)N1c1nonc1N

STK765310
Synonyms: 7-benzyl-1-(3-chlorobenzyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1cccc(c1)Cn1c(=O)n(C)c2c(c1=O)n(cn2)Cc1ccccc1

STK677539
Synonyms: 2-bromo-3-methyl-6-[(2,3,3,3-tetrafluoro-2-methoxypropanoyl)amino]benzoicacid
Smiles: COC(C(F)(F)F)(C(=O)Nc1ccc(c(c1C(=O)O)Br)C)F

STK677540
Synonyms: 2-chloro-6-[(2,3,3,3-tetrafluoro-2-methoxypropanoyl)amino]benzoicacid
Smiles: COC(C(F)(F)F)(C(=O)Nc1cccc(c1C(=O)O)Cl)F

STK765331
Synonyms: 4-(5-{4-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]phenyl}-1,2,4-oxadiazol-3-yl)-1,2,5-oxadiazol-3-amine
Smiles: Cc1cc(nn1Cc1ccc(cc1)c1onc(n1)c1nonc1N)[N+](=O)[O-]

STK677542
Synonyms: N-[3-cyano-4-(furan-2-yl)-6-phenylpyridin-2-yl]acetamide
Smiles: N#Cc1c(NC(=O)C)nc(cc1c1ccco1)c1ccccc1

STK765336
Synonyms: propan-2-yl2-{[3-(1H-benzotriazol-1-yl)propanoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CC(OC(=O)c1c(NC(=O)CCn2nnc3c2cccc3)sc2c1CCCC2)C

STK765338
Synonyms: 3,6-dibenzyl-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Smiles: O=c1n(cnc2c1nnn2Cc1ccccc1)Cc1ccccc1

STK677544
Synonyms: 3-amino-3-imino-2-[(E)-(4-methoxyphenyl)diazenyl]propanamide
Smiles: COc1ccc(cc1)/N=N/C(C(=O)N)C(=N)N

STK765339
Synonyms: 2-(4-methoxyphenyl)-2,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Smiles: COc1ccc(cc1)n1nc2c(n1)nc[nH]c2=O

STK677545
Synonyms: 1-(2-chloro-10H-phenothiazin-10-yl)-2-[(pyridin-3-ylmethyl)amino]ethanone
Smiles: Clc1ccc2c(c1)N(C(=O)CNCc1cccnc1)c1c(S2)cccc1

STK677546
Synonyms: 1-{[(5-amino-1H-tetrazol-1-yl)acetyl](benzyl)amino}-N-(2,6-dimethylphenyl)cyclohexanecarboxamide
Smiles: O=C(N(C1(CCCCC1)C(=O)Nc1c(C)cccc1C)Cc1ccccc1)Cn1nnnc1N

STK765344
Synonyms: [4-(4-chlorophenyl)piperazin-1-yl][4-(trifluoromethyl)phenyl]methanone
Smiles: Clc1ccc(cc1)N1CCN(CC1)C(=O)c1ccc(cc1)C(F)(F)F

STK765345
Synonyms: 2-[4-(trifluoromethyl)phenyl][1]benzofuro[3,2-d]pyrimidin-4(3H)-one
Smiles: O=c1[nH]c(nc2c1oc1c2cccc1)c1ccc(cc1)C(F)(F)F

STK765347
Synonyms: 6-amino-3-(4-ethoxyphenyl)-4-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCOc1ccc(cc1)c1n[nH]c2c1C(C(=C(O2)N)C#N)c1c[nH]nc1c1ccc(cc1)F

STK765348
Synonyms: 6-amino-3-(1,3-benzodioxol-5-yl)-4-(3,5-dichloro-2-methoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cc(Cl)cc(c1OC)Cl)c(n[nH]2)c1ccc2c(c1)OCO2

STK677551
Synonyms: 1-(4-{4-[(3,4-dichlorophenyl)carbonyl]piperazin-1-yl}-5-fluoro-2-methylphenyl)ethanone
Smiles: O=C(c1ccc(c(c1)Cl)Cl)N1CCN(CC1)c1cc(C)c(cc1F)C(=O)C

STK765352
Synonyms: 1,1-bis(4-fluorophenyl)but-2-yne-1,4-diol
Smiles: OCC#CC(c1ccc(cc1)F)(c1ccc(cc1)F)O

STK765356
Synonyms: (4-bromophenyl)[4-(2-fluoro-4-nitrophenyl)piperazin-1-yl]methanone
Smiles: Brc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(cc1F)[N+](=O)[O-]

STK677553
Synonyms: 1-(2-fluoro-5-methyl-4-nitrophenyl)piperazine
Smiles: Fc1cc([N+](=O)[O-])c(cc1N1CCNCC1)C

STK765367
Synonyms: [5-fluoro-2-methyl-4-(morpholin-4-yl)phenyl](phenyl)methanone
Smiles: Cc1cc(N2CCOCC2)c(cc1C(=O)c1ccccc1)F

STK765369
Synonyms: 1-(4-{4-[(3,4-difluorophenyl)carbonyl]piperazin-1-yl}-5-fluoro-2-methylphenyl)ethanone
Smiles: O=C(c1ccc(c(c1)F)F)N1CCN(CC1)c1cc(C)c(cc1F)C(=O)C

STK765371
Synonyms: 1-{3-fluoro-4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl}ethanone
Smiles: Fc1cc(ccc1N1CCN(CC1)C(=O)c1ccccc1)C(=O)C

STK765373
Synonyms: 1-(4-{4-[(4,5-difluoro-2-nitrophenyl)carbonyl]piperazin-1-yl}-3-fluorophenyl)ethanone
Smiles: CC(=O)c1ccc(c(c1)F)N1CCN(CC1)C(=O)c1cc(F)c(cc1[N+](=O)[O-])F

STK677555
Synonyms: 1-(4-{4-[(3,4-dichlorophenyl)carbonyl]piperazin-1-yl}-3-fluorophenyl)ethanone
Smiles: O=C(c1ccc(c(c1)Cl)Cl)N1CCN(CC1)c1ccc(cc1F)C(=O)C

STK765374
Synonyms: 1-(4-{4-[(4,5-difluoro-2-methylphenyl)carbonyl]piperazin-1-yl}-3-fluorophenyl)ethanone
Smiles: CC(=O)c1ccc(c(c1)F)N1CCN(CC1)C(=O)c1cc(F)c(cc1C)F

STK765384
Synonyms: 2-(3-fluorophenyl)-10-iminotetrahydro-8a,3-(epoxymethano)chromene-3,4,4(2H,4aH)-tricarbonitrile
Smiles: N#CC12C(=N)OC3(OC1c1cccc(c1)F)C(C2(C#N)C#N)CCCC3

STK765385
Synonyms: 3-(3-fluorophenyl)-5-imino-1,7-dimethyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile
Smiles: N#CC12C(=N)OC(OC1c1cccc(c1)F)(C(C2(C#N)C#N)C)C

STK765405
Synonyms: (4-{4-[(3,5-di-tert-butyl-4-hydroxyphenyl)sulfanyl]phthalazin-1-yl}phenyl)(morpholin-4-yl)methanone
Smiles: O=C(c1ccc(cc1)c1nnc(c2c1cccc2)Sc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)N1CCOCC1

STK765406
Synonyms: 5,7-dimethyl-3-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyrimidine
Smiles: Cc1cc(C)n2c(n1)nnc2C(F)(F)F

STK677559
Synonyms: 6-chloro-5-methyl-3-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyrimidin-7-ol
Smiles: Oc1nc2nnc(n2c(c1Cl)C)C(F)(F)F

STK765407
Synonyms: 4-{5-[(4-chloro-3-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1,2,5-oxadiazol-3-amine
Smiles: Clc1ccc(cc1C)OCc1onc(n1)c1nonc1N

STK765409
Synonyms: 4-[5-(4-chloro-1-methyl-1H-pyrazol-5-yl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: Clc1cnn(c1c1onc(n1)c1nonc1N)C

STK765417
Synonyms: 4-[4-({4-[chloro(difluoro)methoxy]phenyl}amino)phthalazin-1-yl]-N-(propan-2-yl)benzamide
Smiles: CC(NC(=O)c1ccc(cc1)c1nnc(c2c1cccc2)Nc1ccc(cc1)OC(Cl)(F)F)C

STK765418
Synonyms: 4-[4-({4-[chloro(difluoro)methoxy]phenyl}amino)phthalazin-1-yl]benzamide
Smiles: NC(=O)c1ccc(cc1)c1nnc(c2c1cccc2)Nc1ccc(cc1)OC(Cl)(F)F

STK765424
Synonyms: 6-nitroquinolin-8-yl2,3,3,3-tetrafluoro-2-methoxypropanoate
Smiles: COC(C(F)(F)F)(C(=O)Oc1cc(cc2c1nccc2)[N+](=O)[O-])F

STK765427
Synonyms: N-(3-chlorophenyl)-3-[(2,3,3,3-tetrafluoro-2-methoxypropanoyl)amino]benzamide
Smiles: COC(C(F)(F)F)(C(=O)Nc1cccc(c1)C(=O)Nc1cccc(c1)Cl)F

STK677566
Synonyms: N-[1-(phenylcarbamoyl)cyclohexyl]-4-(1H-tetrazol-1-yl)benzamide
Smiles: O=C(C1(CCCCC1)NC(=O)c1ccc(cc1)n1cnnn1)Nc1ccccc1

STK765432
Synonyms: N-{2-[(2,6-dimethylphenyl)amino]-2-oxo-1-phenylethyl}-4-(1H-tetrazol-1-yl)benzamide
Smiles: O=C(C(c1ccccc1)NC(=O)c1ccc(cc1)n1cnnn1)Nc1c(C)cccc1C

STK765434
Synonyms: N-{2-[(2,6-dimethylphenyl)amino]-1-(4-hydroxy-3-methoxyphenyl)-2-oxoethyl}-4-(1H-tetrazol-1-yl)benzamide
Smiles: COc1cc(ccc1O)C(C(=O)Nc1c(C)cccc1C)NC(=O)c1ccc(cc1)n1cnnn1

STK765435
Synonyms: N-{1-[(4-methylphenyl)carbamoyl]cyclohexyl}-4-(1H-tetrazol-1-yl)benzamide
Smiles: Cc1ccc(cc1)NC(=O)C1(CCCCC1)NC(=O)c1ccc(cc1)n1cnnn1

STK765436
Synonyms: 2-[5-(2-methylphenyl)-2H-tetrazol-2-yl]-N-(2-phenylethyl)acetamide
Smiles: O=C(Cn1nnc(n1)c1ccccc1C)NCCc1ccccc1

STK765437
Synonyms: 2-[5-(2-fluorophenyl)-2H-tetrazol-2-yl]-N-(2-phenylethyl)acetamide
Smiles: O=C(Cn1nnc(n1)c1ccccc1F)NCCc1ccccc1

STK765438
Synonyms: N-[(2E,5E)-5-{[1-acetyl-3-(4-fluorophenyl)-1H-pyrazol-4-yl]methylidene}-4-oxo-1,3-thiazolidin-2-ylidene]acetamide
Smiles: CC(=O)n1cc(c(n1)c1ccc(cc1)F)/C=C\1/S/C(=N/C(=O)C)/NC1=O

STK677569
Synonyms: 2-{6-[(4aS,9bR)-2,8-dimethyl-1,2,3,4,4a,9b-hexahydro-5H-pyrido[4,3-b]indol-5-yl]-6-oxohexyl}-1H-isoindole-1,3(2H)-dione
Smiles: CN1CC[C@H]2[C@@H](C1)c1cc(C)ccc1N2C(=O)CCCCCN1C(=O)c2c(C1=O)cccc2

STK677571
Synonyms: 5-(4-bromophenyl)-3-hydroxy-1-(2-phenylethyl)-4-(thiophen-2-ylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Brc1ccc(cc1)C1N(CCc2ccccc2)C(=O)C(=C1C(=O)c1cccs1)O

STK765453
Synonyms: 3-amino-4-formyl-2-[2-oxo-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]cyclopent-3-ene-1,1,2-tricarbonitrile
Smiles: O=CC1=C(N)C(C(C1)(C#N)C#N)(C#N)CC(=O)C12CC3CC(C2)CC(C1)C3

STK765455
Synonyms: 2,6,6-trimethyl-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one
Smiles: O=C1CC(C)(C)Cc2c1c(CC(Cl)(Cl)Cl)c([nH]2)C

STK765463
Synonyms: 1-(4-fluoro-3-nitrophenyl)-2,6,6-trimethyl-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one
Smiles: O=C1CC(C)(C)Cc2c1c(CC(Cl)(Cl)Cl)c(n2c1ccc(c(c1)[N+](=O)[O-])F)C

STK765466
Synonyms: 1-(dimethylamino)-2,6,6-trimethyl-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one
Smiles: O=C1CC(C)(C)Cc2c1c(CC(Cl)(Cl)Cl)c(n2N(C)C)C

STK677576
Synonyms: [1-(4-bromophenyl)-2,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indol-3-yl]aceticacid
Smiles: OC(=O)Cc1c(C)n(c2c1C(=O)CC(C2)(C)C)c1ccc(cc1)Br

STK765476
Synonyms: 4-(2-amino-3-cyano-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-4-yl)-2-methoxyphenylmorpholine-4-carboxylate
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(c(c1)OC)OC(=O)N1CCOCC1)c(=O)oc(c2)C

STK765478
Synonyms: 6-amino-4-(1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc3c(c1)OCO3)c(n[nH]2)c1ccc(cc1)F

STK765483
Synonyms: 2-methyl-N-(2-methylbut-3-yn-2-yl)-5-{4-[(3-methylphenyl)amino]phthalazin-1-yl}benzenesulfonamide
Smiles: C#CC(NS(=O)(=O)c1cc(ccc1C)c1nnc(c2c1cccc2)Nc1cccc(c1)C)(C)C

STK765490
Synonyms: 2-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1H-benzimidazol-1-yl]-N-{4-[chloro(difluoro)methoxy]phenyl}acetamide
Smiles: O=C(Cn1c(nc2c1cccc2)c1nonc1N)Nc1ccc(cc1)OC(Cl)(F)F

STK765499
Synonyms: 2,4,5,6-tetrachloro-N-(4-methylphenyl)pyridine-3-carboxamide
Smiles: Cc1ccc(cc1)NC(=O)c1c(Cl)nc(c(c1Cl)Cl)Cl

STK765500
Synonyms: 2,4,5,6-tetrachloropyridine-3-carboxamide
Smiles: NC(=O)c1c(Cl)nc(c(c1Cl)Cl)Cl

STK677580
Synonyms: N-benzyl-5-chloro-3-cyano-N,4,6-trimethylpyridine-2-sulfonamide
Smiles: N#Cc1c(C)c(Cl)c(nc1S(=O)(=O)N(Cc1ccccc1)C)C

STK765505
Synonyms: methyl2,4,6-trichloro-5-nitropyridine-3-carboxylate
Smiles: COC(=O)c1c(Cl)nc(c(c1Cl)[N+](=O)[O-])Cl

STK677583
Synonyms: 2-chloro-N-[(4-chlorobenzyl)carbamoyl]-4,6-dimethyl-5-nitropyridine-3-carboxamide
Smiles: O=C(NC(=O)c1c(Cl)nc(c(c1C)[N+](=O)[O-])C)NCc1ccc(cc1)Cl

STK765513
Synonyms: N-[4-(4,4-diethyl-1,4-dihydro-2H-3,1-benzoxazin-2-yl)phenyl]acetamide
Smiles: CCC1(CC)OC(Nc2c1cccc2)c1ccc(cc1)NC(=O)C

STK677585
Synonyms: 4,4-diethyl-2-(pyridin-2-yl)-1,4-dihydro-2H-3,1-benzoxazine
Smiles: CCC1(CC)OC(Nc2c1cccc2)c1ccccn1

STK765515
Synonyms: 4,4-diethyl-2-(pyridin-3-yl)-1,4-dihydro-2H-3,1-benzoxazine
Smiles: CCC1(CC)OC(Nc2c1cccc2)c1cccnc1

STK765516
Synonyms: 4,4-diphenyl-2-(pyridin-3-yl)-1,4-dihydro-2H-3,1-benzoxazine
Smiles: c1ccc(cc1)C1(OC(Nc2c1cccc2)c1cccnc1)c1ccccc1

STK765521
Synonyms: N-{4-[(E)-(6-methyl-3,4-dioxo-4,5-dihydrofuro[3,4-c]pyridin-1(3H)-ylidene)methyl]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)/C=C\1/OC(=O)c2c1cc(C)[nH]c2=O

STK765522
Synonyms: (1E)-1-(2,3-dimethoxybenzylidene)-6-methylfuro[3,4-c]pyridine-3,4(1H,5H)-dione
Smiles: COc1c(cccc1OC)/C=C\1/OC(=O)c2c1cc(C)[nH]c2=O

STK765523
Synonyms: (1E)-1-(4-ethoxy-3-methoxybenzylidene)-6-methylfuro[3,4-c]pyridine-3,4(1H,5H)-dione
Smiles: CCOc1ccc(cc1OC)/C=C\1/OC(=O)c2c1cc(C)[nH]c2=O

STK765527
Synonyms: methyl(6-nitro-1-oxido-3-oxo-1,2-benzothiazol-2(3H)-yl)acetate
Smiles: COC(=O)Cn1c(=O)c2c(s1=O)cc(cc2)[N+](=O)[O-]

STK765528
Synonyms: methyl(6-nitro-3-oxo-1,2-benzothiazol-2(3H)-yl)acetate
Smiles: COC(=O)Cn1sc2c(c1=O)ccc(c2)[N+](=O)[O-]

STK765531
Synonyms: N-{2-[(3-chlorophenyl)amino]-2-phenylethyl}-4-methylbenzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)NCC(c1ccccc1)Nc1cccc(c1)Cl

STK677591
Synonyms: N-propanoyl-N-{2-[4-(propanoylamino)-1,2,5-oxadiazol-3-yl]-1H-benzimidazol-1-yl}propanamide
Smiles: CCC(=O)Nc1nonc1c1nc2c(n1N(C(=O)CC)C(=O)CC)cccc2

STK765540
Synonyms: 4-amino-N'-[(2-chloro-6-fluorobenzyl)oxy]-1,2,5-oxadiazole-3-carboximidamide
Smiles: Fc1cccc(c1CO/N=C(/c1nonc1N)\N)Cl

STK765541
Synonyms: ethyl{5-[(4-chlorophenyl)amino][1,2,5]oxadiazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrazin-8-yl}acetate
Smiles: CCOC(=O)Cc1nnc2n1c1nonc1nc2Nc1ccc(cc1)Cl

STK765542
Synonyms: 4-[1-(2-chloro-4-fluorobenzyl)-1H-benzimidazol-2-yl]-1,2,5-oxadiazol-3-amine
Smiles: Fc1ccc(c(c1)Cl)Cn1c(nc2c1cccc2)c1nonc1N

STK765558
Synonyms: N-(4-methylphenyl)-2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc2c(n1)n(C)c1c2cccc1

STK677598
Synonyms: 4-{[4-(phenylsulfonyl)phenyl]sulfonyl}morpholine
Smiles: O=S(=O)(c1ccc(cc1)S(=O)(=O)c1ccccc1)N1CCOCC1

STK677599
Synonyms: 4-{[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]methyl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)CNS(=O)(=O)c1cccc2c1nsn2

STK677601
Synonyms: 2-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline-1-carboxylicacid
Smiles: OC(=O)C1c2ccccc2CCN1S(=O)(=O)c1cccc2c1nsn2

STK677602
Synonyms: N-[4-(trifluoromethoxy)phenyl]-1,3-benzoxazol-2-amine
Smiles: FC(Oc1ccc(cc1)Nc1nc2c(o1)cccc2)(F)F

STK677603
Synonyms: 3-phenyl-1-(piperidin-1-yl)pentan-3-ol
Smiles: CCC(c1ccccc1)(CCN1CCCCC1)O

STK677605
Synonyms: N-{4-[chloro(difluoro)methoxy]phenyl}-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
Smiles: O=c1[nH]c2c(o1)cc(cc2)S(=O)(=O)Nc1ccc(cc1)OC(Cl)(F)F

STK677606
Synonyms: 2-oxo-N-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
Smiles: O=c1[nH]c2c(o1)cc(cc2)S(=O)(=O)Nc1ccc(cc1)OC(F)(F)F

STK765574
Synonyms: 5-chloro-N-{4-[chloro(difluoro)methoxy]phenyl}-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
Smiles: Clc1cc2[nH]c(=O)oc2cc1S(=O)(=O)Nc1ccc(cc1)OC(Cl)(F)F

STK765587
Synonyms: ethyl2-{[2-(4-fluorophenoxy)propanoyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)C(Oc2ccc(cc2)F)C)sc2c1CCCCC2

STK765608
Synonyms: (2E)-N-(4-chloro-2-nitrophenyl)-2-cyano-3-(5-methylfuran-2-yl)prop-2-enamide
Smiles: N#C/C(=C\c1ccc(o1)C)/C(=O)Nc1ccc(cc1[N+](=O)[O-])Cl

STK677611
Synonyms: N-{4-[chloro(difluoro)methoxy]phenyl}-2-[5-(2-chlorophenyl)-2H-tetrazol-2-yl]acetamide
Smiles: O=C(Cn1nnc(n1)c1ccccc1Cl)Nc1ccc(cc1)OC(Cl)(F)F

STK765611
Synonyms: 4-{[2-(4-amino-1,2,5-oxadiazol-3-yl)-1H-benzimidazol-1-yl]methyl}-6-(piperidin-1-yl)-1,3,5-triazin-2-amine
Smiles: Nc1nc(nc(n1)N1CCCCC1)Cn1c(nc2c1cccc2)c1nonc1N

STK765613
Synonyms: 3-benzyl-7-methyl-6-thioxo-1,3,6,7-tetrahydro-2H-purin-2-one
Smiles: Cn1cnc2c1c(=S)[nH]c(=O)n2Cc1ccccc1

STK765615
Synonyms: (2,3-difluorophenyl)(2-methylpiperidin-1-yl)methanone
Smiles: CC1CCCCN1C(=O)c1cccc(c1F)F

STK765616
Synonyms: 1H-benzotriazol-1-yl(3,4-difluorophenyl)methanone
Smiles: Fc1ccc(cc1F)C(=O)n1nnc2c1cccc2

STK765627
Synonyms: 1-(4-{4-[(3,4-difluorophenyl)carbonyl]piperazin-1-yl}-3-fluorophenyl)butan-1-one
Smiles: CCCC(=O)c1ccc(c(c1)F)N1CCN(CC1)C(=O)c1ccc(c(c1)F)F

STK677615
Synonyms: ethyl5-chloro-2-oxo-1,3-benzoxazole-3(2H)-carboxylate
Smiles: CCOC(=O)n1c(=O)oc2c1cc(Cl)cc2

STK765635
Synonyms: 5-chloro-N-cyclohexyl-2-oxo-1,3-benzoxazole-3(2H)-carboxamide
Smiles: Clc1ccc2c(c1)n(C(=O)NC1CCCCC1)c(=O)o2

STK765638
Synonyms: 5-pentanoylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCCCC(=O)C1C(=O)NC(=O)NC1=O

STK765639
Synonyms: 1,1,10b-trimethyl-1,5,6,10b-tetrahydro[1,3]oxazolo[4,3-a]isoquinolin-3-one
Smiles: O=C1OC(C2(N1CCc1c2cccc1)C)(C)C

STK677617
Synonyms: N-(2-chlorophenyl)-2-(1-methoxy-3,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-1-yl)-2-oxoacetamide
Smiles: COC1(NC(C)(C)Cc2c1cccc2)C(=O)C(=O)Nc1ccccc1Cl

STK765645
Synonyms: ethyl1-(2-cyclopentylethyl)-5-hydroxy-2-methyl-1H-benzo[g]indole-3-carboxylate
Smiles: CCOC(=O)c1c(C)n(c2c1cc(O)c1c2cccc1)CCC1CCCC1

STK677620
Synonyms: methyl4-(6-chloro-4H-1,3-benzodioxin-8-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: COC(=O)C1=C(C)NC(=O)NC1c1cc(Cl)cc2c1OCOC2

STK677621
Synonyms: methyl3'-(4-methoxyphenyl)-3H,3'H-spiro[1,3-benzothiazole-2,2'-[1,3,4]thiadiazole]-5'-carboxylate
Smiles: COc1ccc(cc1)N1N=C(SC21Nc1c(S2)cccc1)C(=O)OC

STK765651
Synonyms: 2-(4-bromophenyl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazolidine-3-carbothioamide
Smiles: Brc1ccc(cc1)C1SCCN1C(=S)Nc1cccc(c1)C(F)(F)F

STK765654
Synonyms: methyl2-[(4-cyclopropyl-1,3-thiazol-2-yl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1ccccc1)Nc1scc(n1)C1CC1