FULL DB

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

STK586267
Synonyms: (5Z)-6-hydroxy-5-[(2E)-1-hydroxy-3-(1H-indol-3-yl)prop-2-en-1-ylidene]-3-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
Smiles: C=CCN1C(=O)N=C(/C(=C(\C=C\c2c[nH]c3c2cccc3)/O)/C1=O)O

STK586268
Synonyms: (5Z)-6-hydroxy-5-[(2E)-1-hydroxy-3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-ylidene]-3-(3-methoxypropyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COCCCN1C(=O)N=C(/C(=C(\C=C\c2ccc(c(c2)OC)O)/O)/C1=O)O

STK586270
Synonyms: 2-{[3-cyano-4-(furan-2-yl)-6-hydroxy-4,5-dihydropyridin-2-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc3c2cccc3)N=C(CC1c1ccco1)O

STK586272
Synonyms: 8-(heptylsulfanyl)-6-hydroxy-3-methyl-7-(2-methylprop-2-en-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: CCCCCCCSc1nc2c(n1CC(=C)C)c(O)nc(=O)n2C

STK586274
Synonyms: N'-[(E)-(2,3-dimethoxyphenyl)methylidene]-4-methoxy-1H-indole-2-carbohydrazide
Smiles: COc1c(/C=N/NC(=O)c2cc3c([nH]2)cccc3OC)cccc1OC

STK586275
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)-3-(2,5-dimethoxyphenyl)-6-[2-(dimethylamino)ethyl]-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: COc1ccc(cc1C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)CCN(C)C)OC

STK586276
Synonyms: 2-[7-(3,4-dichlorophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]-5-methoxyphenol
Smiles: COc1ccc(c(c1)O)c1nc2n(n1)cnc1c2cnn1c1ccc(c(c1)Cl)Cl

STK586279
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[methyl(phenyl)amino]methyl}-N'-[(1E)-1-phenylpropylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CC/C(=N\NC(=O)c1nnn(c1CN(c1ccccc1)C)c1nonc1N)/c1ccccc1

STK586280
Synonyms: 2-[(5Z)-5-(2-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[2-(4-hydroxyphenyl)ethyl]acetamide
Smiles: O=C(CN1C(=S)S/C(=C\c2ccccc2F)/C1=O)NCCc1ccc(cc1)O

STK586282
Synonyms: 3-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}quinazolin-4(3H)-one
Smiles: Clc1cccc(c1)N1CCN(CC1)C(=O)Cn1cnc2c(c1=O)cccc2

STK586284
Synonyms: 2-tert-butyl4-ethyl5-[(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)amino]-3-methylthiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(NC2OC(=O)c3c2ccc(c3OC)OC)sc(c1C)C(=O)OC(C)(C)C

STK586285
Synonyms: N-(4-methylphenyl)-2-{[4-phenyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc(n1c1ccccc1)c1ccccn1

STK586286
Synonyms: (3a'S,6a'R)-5-bromo-3'-(1-hydroxyethyl)-5'-(2-phenylethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Brc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)CCc1ccccc1)C(O)C)C(=O)N2

STK586287
Synonyms: 7-(2-chloro-6-fluorobenzyl)-10-fluoro-3,4-dihydro-2H-[1,3]thiazino[3',2':1,2]pyrimido[5,4-b]indol-6(7H)-one
Smiles: Fc1ccc2c(c1)c1nc3SCCCn3c(=O)c1n2Cc1c(F)cccc1Cl

STK586289
Synonyms: (3R,3'S,5'S)-N-(4-fluorophenyl)-5-methyl-5'-(2-methylpropyl)-2-oxo-1,2-dihydrospiro[indole-3,2'-pyrrolidine]-3'-carboxamide
Smiles: CC(C[C@H]1C[C@@H]([C@]2(N1)C(=O)Nc1c2cc(C)cc1)C(=O)Nc1ccc(cc1)F)C

STK586290
Synonyms: (5Z)-5-[5-(3,4-dimethoxyphenyl)pyrazolidin-3-ylidene]-6-hydroxy-3-(3-methoxypropyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COCCCN1C(=O)N=C(/C(=C\2/NNC(C2)c2ccc(c(c2)OC)OC)/C1=O)O

STK586291
Synonyms: 2-{[5-(3-chlorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methoxyphenyl)ethanone
Smiles: COc1ccc(cc1)C(=O)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK586293
Synonyms: 1-(4-chlorophenyl)-2-{[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Cl)nnc1COc1ccccc1

STK586294
Synonyms: 6-(4-fluorophenyl)-2-[(4-methylquinazolin-2-yl)amino]pyrimidin-4-ol
Smiles: Oc1nc(Nc2nc(C)c3c(n2)cccc3)nc(c1)c1ccc(cc1)F

STK586295
Synonyms: 3-butyl-8-(3-methoxyphenyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: CCCCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1cccc(c1)OC

STK586297
Synonyms: (5E)-3-butyl-5-{1-[(4-fluorobenzyl)amino]ethylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCCCN1C(=O)N=C(/C(=C(\NCc2ccc(cc2)F)/C)/C1=O)O

STK586298
Synonyms: N-(3-ethoxypropyl)-2-(ethylsulfanyl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
Smiles: CCOCCCNc1nc(SCC)nc2c1c1CC(C)(C)OCc1s2

STK586299
Synonyms: 2-{[5-(4-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCC(=O)Nc1ccc(cc1)C

STK586300
Synonyms: N-(3,4-dimethylphenyl)-2-{[4-(4-methylphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)C)C)CSc1nnc(n1c1ccc(cc1)C)c1ccccn1

STK586302
Synonyms: 2-({4-amino-5-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,6-dimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cccc1C)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK586303
Synonyms: N-(3-hydroxypropyl)-5,10-dimethyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: OCCCNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CC(C)CC2

STK586304
Synonyms: N'-[(E)-quinoxalin-6-ylmethylidene]pyridine-4-carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/c1ccc2c(c1)nccn2

STK586306
Synonyms: 9-(3-chlorophenyl)-3-(2-methoxyethyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COCCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1cccc(c1)Cl

STK586308
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-fluorophenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)F)nnc1COc1ccc(cc1)Cl

STK586309
Synonyms: (4E)-1-butyl-4-[hydroxy(phenyl)methylidene]-5-phenylpyrrolidine-2,3-dione
Smiles: CCCCN1C(c2ccccc2)/C(=C(/c2ccccc2)\O)/C(=O)C1=O

STK586310
Synonyms: (4E)-4-[(1-{3-[benzyl(methyl)amino]-2-hydroxypropyl}-1H-indol-3-yl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CN(CC(Cn1cc(c2c1cccc2)/C=C/1\C(=NN(C1=O)c1ccccc1)C)O)Cc1ccccc1

STK586311
Synonyms: N-[(1Z)-3-(azepan-1-yl)-1-(2-hydroxy-7-methoxyquinolin-3-yl)-3-oxoprop-1-en-2-yl]benzamide
Smiles: COc1ccc2c(c1)nc(c(c2)/C=C(/C(=O)N1CCCCCC1)\NC(=O)c1ccccc1)O

STK586312
Synonyms: N-(2-ethylphenyl)-2-{[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCc1ccccc1NC(=O)CSc1nnc(n1Cc1ccco1)COc1ccccc1

STK586314
Synonyms: 3-(2-ethoxyphenyl)-1',3'-dimethyl-8-nitro-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CCOc1ccccc1N1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)N(C)C(=O)N(C1=O)C

STK586316
Synonyms: 1-amino-4-[(4-fluorophenyl)amino]-2-(morpholin-4-yl)anthracene-9,10-dione
Smiles: Fc1ccc(cc1)Nc1cc(N2CCOCC2)c(c2c1C(=O)c1ccccc1C2=O)N

STK586317
Synonyms: N-[(2Z)-5-(benzylsulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxo-4H-chromene-2-carboxamide
Smiles: O=C(c1cc(=O)c2c(o1)cccc2)/N=c\1/[nH]nc(s1)SCc1ccccc1

STK586318
Synonyms: (3a'S,6a'R)-5-chloro-5'-(2-chlorobenzyl)-3'-(1-hydroxyethyl)-7-methyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CC(C1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2cc(Cl)cc1C)O

STK586322
Synonyms: 7-fluoro-2-(5-methyl-1,2-oxazol-3-yl)-1-(pyridin-4-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccncc1)c1noc(c1)C

STK586323
Synonyms: 5-({2-[(2-fluorobenzyl)oxy]-3-methoxybenzyl}amino)-2-(morpholin-4-ium-4-yl)benzoate
Smiles: COc1cccc(c1OCc1ccccc1F)CNc1ccc(c(c1)C(=O)[O-])[NH+]1CCOCC1

STK586324
Synonyms: 4-{[(E)-(3,5-dibromo-2-hydroxyphenyl)methylidene]amino}-5-(pyridin-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Brc1cc(/C=N/n2c(=S)[nH]nc2c2cccnc2)c(c(c1)Br)O

STK586326
Synonyms: N-(2-bromophenyl)-2-{[5-(3-chlorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1Br)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK586328
Synonyms: N-(3,4-dichlorophenyl)-4-(4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)CCCn1cnc2c(c1=O)cccc2

STK586329
Synonyms: 2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)-N-(pyridin-2-ylmethyl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)c(O)cc(c2)C)NCc1ccccn1

STK586331
Synonyms: 2-methyl-N-(4-methylphenyl)-N-[(2-oxo-1,2-dihydroquinolin-4-yl)methyl]propanamide
Smiles: Cc1ccc(cc1)N(C(=O)C(C)C)Cc1cc(=O)[nH]c2c1cccc2

STK586332
Synonyms: 5-(4-chlorophenyl)-3-(2-hydroxyphenyl)-1-(1H-indol-3-ylmethyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylicacid
Smiles: Clc1ccc(cc1)N1C(=O)C2C(C1=O)C(NC2c1ccccc1O)(Cc1c[nH]c2c1cccc2)C(=O)O

STK586333
Synonyms: (5E)-5-{1-[(4-fluorophenyl)amino]propylidene}-6-hydroxy-3-(2-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccccc1C)O)/Nc1ccc(cc1)F

STK586335
Synonyms: N-(2-chloro-4,6-dimethylphenyl)-2-{[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2c(C)cc(cc2Cl)C)nnc1c1cccc(c1)Cl

STK586337
Synonyms: 3-[(naphthalen-1-ylmethyl)sulfanyl]-5-(5-phenyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-4-amine
Smiles: Nn1c(SCc2cccc3c2cccc3)nnc1c1n[nH]c(c1)c1ccccc1

STK586338
Synonyms: 5-(3-methylphenyl)-4-{[(1E,2E)-3-phenylprop-2-en-1-ylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1cccc(c1)c1n[nH]c(=S)n1/N=C/C=C/c1ccccc1

STK586339
Synonyms: N-(3-chloro-2-methylphenyl)-2-{[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: Cc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1cccc(c1C)Cl

STK586340
Synonyms: 4-methoxy-N-(2-methylpropyl)-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COc1ccc(cc1)C(=O)N(Cc1cc2ccccc2[nH]c1=O)CC(C)C

STK586342
Synonyms: 1-(4-ethoxyphenyl)-3-{4-hydroxy-6-[(pyridin-2-ylsulfanyl)methyl]pyrimidin-2-yl}guanidine
Smiles: CCOc1ccc(cc1)NC(=N)Nc1nc(O)cc(n1)CSc1ccccn1

STK586343
Synonyms: 2-{4-[6-hydroxy-3-methyl-2-oxo-7-(3-phenylpropyl)-3,7-dihydro-2H-purin-8-yl]piperazin-1-yl}acetamide
Smiles: NC(=O)CN1CCN(CC1)c1nc2c(n1CCCc1ccccc1)c(O)nc(=O)n2C

STK586346
Synonyms: (3Z)-1-(4-chloro-3-methylphenoxy)-3-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)propan-2-one
Smiles: O=C(/C=C/1\NCCc2c1cc1OCCCOc1c2)COc1ccc(c(c1)C)Cl

STK586349
Synonyms: 8-benzyl-N-(3-methoxypropyl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-amine
Smiles: COCCCNc1nc2nnnn2c2c1c1CCN(Cc1s2)Cc1ccccc1

STK586350
Synonyms: 4-nitro-N-[2-(2-phenylethyl)-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-8-yl]benzamide
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])Nc1ccc2c(c1)nc1n2CCN(C1)CCc1ccccc1

STK586351
Synonyms: 8-[bis(2-hydroxyethyl)amino]-6-hydroxy-7-[2-hydroxy-3-(4-methylphenoxy)propyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: OCCN(c1nc2c(n1CC(COc1ccc(cc1)C)O)c(O)nc(=O)n2C)CCO

STK586352
Synonyms: (4E)-5-(3-butoxyphenyl)-1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Smiles: CCCCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccccc2Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK586353
Synonyms: 2-{[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-sulfamoylphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)S(=O)(=O)N)nnc1c1cccc(c1)C

STK586354
Synonyms: 1-(4-chlorophenyl)-6-(furan-2-ylmethyl)-2-hydroxy-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Clc1ccc(cc1)n1c(O)nc(=O)c2c1NCN(C2)Cc1ccco1

STK586356
Synonyms: N-[2-(2-hydroxyethoxy)ethyl]-5-methyl-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: OCCOCCNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CCC2

STK586358
Synonyms: N,4-bis(4-chlorophenyl)-1-(4-ethylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCc1ccc(cc1)c1c(C(=O)Nc2ccc(cc2)Cl)n2c3c1CCCCn3c(c2)c1ccc(cc1)Cl

STK586359
Synonyms: N'-[(E)-(4-ethoxyphenyl)methylidene]-5-methoxy-1H-indole-2-carbohydrazide
Smiles: CCOc1ccc(cc1)/C=N/NC(=O)c1cc2c([nH]1)ccc(c2)OC

STK586362
Synonyms: N-[(2E)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]-2-[(4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]acetamide
Smiles: CCc1n[nH]/c(=N\C(=O)CSc2nc3ccccc3c(=O)n2c2ccccc2)/s1

STK586363
Synonyms: 8-[(4-benzylpiperazin-1-yl)methyl]-7-ethyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCn1c(CN2CCN(CC2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK586364
Synonyms: N-(3,5-dimethoxyphenyl)-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cc(NC(=O)CSc2nnc(n2c2ccccc2)c2cnccn2)cc(c1)OC

STK586365
Synonyms: 2-[(2Z)-4-hydroxy-2-(phenylimino)-2,5-dihydro-1,3-thiazol-5-yl]-N-(3-methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CC1S/C(=N\c2ccccc2)/N=C1O

STK586367
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)-3-[4-(benzyloxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: O=C1N(c2cccc(c2)C(F)(F)F)C(=O)[C@@H]2[C@H]1[C@H]1C[C@@H]2[C@@H]2[C@H]1C(=NO2)c1ccc(cc1)OCc1ccccc1

STK586368
Synonyms: 3'-(4-bromophenyl)-6'-hydroxy-2,4-dimethyl-8-nitro-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4'(3'H)-dione
Smiles: CC1OC(C)C2N(C1)c1ccc(cc1CC12C(=NC(=O)N(C1=O)c1ccc(cc1)Br)O)[N+](=O)[O-]

STK586370
Synonyms: N-(3,4-dimethoxyphenyl)-2-{[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)OC)OC)nnc1COc1ccccc1

STK586371
Synonyms: 2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,4-dimethoxyphenyl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(c(c1)OC)OC

STK586372
Synonyms: tert-butyl(3S)-3-({(2R)-1-[(3-methylphenyl)amino]-1-oxopropan-2-yl}carbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
Smiles: Cc1cccc(c1)NC(=O)[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)C

STK586373
Synonyms: N-[(2Z)-3-(2,3-dimethylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: CC(=O)/N=C/1\SC2C(N1c1cccc(c1C)C)CS(=O)(=O)C2

STK586374
Synonyms: N-cyclohexyl-5-methoxy-N,3-dimethyl-1H-indole-2-carboxamide
Smiles: COc1ccc2c(c1)c(C)c([nH]2)C(=O)N(C1CCCCC1)C

STK586375
Synonyms: (2'S,3S,3'S,10b'R)-3'-(1,3-benzodioxol-5-ylcarbonyl)-2'-[(4-methylphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: Cc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc3c(c2)OCO3)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK586376
Synonyms: 2-{[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cc(cc1C)C)CSc1nnc(n1Cc1ccco1)c1cccc(c1)C

STK586377
Synonyms: (3a'S,6a'R)-5'-tert-butyl-3'-[2-(methylsulfanyl)ethyl]-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CSCCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C(C)(C)C)C(=O)Nc1c2cccc1

STK586379
Synonyms: (E)-{2-(4-bromophenyl)-1-[2-(diethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(4-chlorophenyl)methanolate
Smiles: CC[NH+](CCN1C(c2ccc(cc2)Br)/C(=C(/c2ccc(cc2)Cl)\[O-])/C(=O)C1=O)CC

STK586381
Synonyms: N-[3-(4-methoxyphenyl)-3-phenylpropyl]cyclohexanecarboxamide
Smiles: COc1ccc(cc1)C(c1ccccc1)CCNC(=O)C1CCCCC1

STK586383
Synonyms: 4-[(2E)-2-{4-methoxy-3-[(3-methoxyphenoxy)methyl]benzylidene}hydrazinyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: COc1ccc(cc1COc1cccc(c1)OC)/C=N/Nc1ncnc2c1c1CCCCc1s2

STK586384
Synonyms: 1-(4-methoxyphenyl)-6,7-dimethyl-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc(cc1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)C)C

STK586385
Synonyms: (5Z)-3-phenyl-5-[(1,3-thiazol-2-ylamino)methylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C\Nc2nccs2)/C(=O)N1c1ccccc1

STK586387
Synonyms: N-{(1Z)-1-[1-cyano-2-(morpholin-4-yl)-2-oxoethylidene]-1H-isoindol-3-yl}furan-2-carboxamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccco1)/C(=O)N1CCOCC1

STK586389
Synonyms: 4-chloro-N-[(1Z)-1-{1-cyano-2-oxo-2-[(2-phenylethyl)amino]ethylidene}-1H-isoindol-3-yl]benzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1)Cl)/C(=O)NCCc1ccccc1

STK586390
Synonyms: 7-(4-chlorobenzyl)-8-[(4-ethylpiperazin-1-yl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN1CCN(CC1)Cc1nc2c(n1Cc1ccc(cc1)Cl)c(=O)n(c(=O)n2C)C

STK586391
Synonyms: 6-amino-1-(4-fluorophenyl)-4-(4-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1ccc(cc1)OC)c(C)nn2c1ccc(cc1)F

STK586396
Synonyms: N-{(1Z)-1-[1-cyano-2-(morpholin-4-yl)-2-oxoethylidene]-1H-isoindol-3-yl}-2-fluorobenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccccc1F)/C(=O)N1CCOCC1

STK586399
Synonyms: 8-benzyl-N-(2-methylpropyl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-amine
Smiles: CC(CNc1nc2nnnn2c2c1c1CCN(Cc1s2)Cc1ccccc1)C

STK586400
Synonyms: 2-{[4-ethyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-phenoxyphenyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)Oc2ccccc2)nnc1COc1ccccc1

STK586401
Synonyms: 4-(4-fluorophenyl)-2-(2-methylphenyl)-5-phenyl-1H-imidazole
Smiles: Fc1ccc(cc1)c1nc([nH]c1c1ccccc1)c1ccccc1C

STK586402
Synonyms: 3-chloro-N-[(2Z)-3-{[2-(4-sulfamoylphenyl)ethyl]amino}quinoxalin-2(1H)-ylidene]benzenesulfonamide
Smiles: Clc1cccc(c1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1NCCc1ccc(cc1)S(=O)(=O)N

STK586404
Synonyms: N~2~-({1-[N-(tert-butoxycarbonyl)-D-phenylalanyl]piperidin-4-yl}carbonyl)-N-(4-fluorophenyl)-D-leucinamide
Smiles: CC(C[C@H](C(=O)Nc1ccc(cc1)F)NC(=O)C1CCN(CC1)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C

STK586405
Synonyms: N-[(2Z)-3-(3,4-dimethoxybenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methylpropanamide
Smiles: COc1cc(ccc1OC)CN1/C(=N/C(=O)C(C)C)/SC2C1CS(=O)(=O)C2

STK586406
Synonyms: N-(1,3-benzodioxol-5-yl)-2-({5-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc3c(c2)OCO3)nnc1COc1ccc(cc1)Cl

STK586407
Synonyms: N-(biphenyl-2-yl)-2-{[5-(4-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCC(=O)Nc1ccccc1c1ccccc1

STK586408
Synonyms: 5-(4-fluorophenyl)-4-{[(E)-(5-methylthiophen-2-yl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccc(s1)C

STK586409
Synonyms: 4,6-dimethoxy-N'-{(E)-[4-(prop-2-en-1-yloxy)phenyl]methylidene}-1H-indole-2-carbohydrazide
Smiles: C=CCOc1ccc(cc1)/C=N/NC(=O)c1cc2c([nH]1)cc(cc2OC)OC

STK586410
Synonyms: N-[4-(dimethylamino)phenyl]-2-{[5-(4-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)N(C)C)nnc1c1ccc(cc1)OC

STK586412
Synonyms: 3-(5-{(Z)-[1-(2-fluorobenzyl)-2-hydroxy-5-oxo-1,5-dihydro-4H-imidazol-4-ylidene]methyl}furan-2-yl)-4-methylbenzoicacid
Smiles: OC(=O)c1ccc(c(c1)c1ccc(o1)/C=C/1\N=C(N(C1=O)Cc1ccccc1F)O)C

STK586413
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(naphthalen-2-yl)ethanone
Smiles: Clc1ccc(cc1)n1c(SCC(=O)c2ccc3c(c2)cccc3)nnc1c1cccc(c1)Cl

STK586414
Synonyms: (5Z)-5-{1-[(furan-2-ylmethyl)amino]propylidene}-6-hydroxy-3-(2-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: CC/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1C)O)/NCc1ccco1

STK586415
Synonyms: N-(2,5-dimethylphenyl)-2-{[4-(4-methoxyphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(C)ccc2C)nnc1Cc1cccs1

STK586417
Synonyms: 4-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-propylpyridine
Smiles: CCCc1nccc(c1)c1scc(n1)c1ccc2c(c1)OCO2

STK586419
Synonyms: N-[1-methyl-3-(3-methylphenyl)-4-oxo-1,4-dihydroquinolin-2-yl]-2-phenylacetamide
Smiles: O=C(Nc1n(C)c2ccccc2c(=O)c1c1cccc(c1)C)Cc1ccccc1

STK586420
Synonyms: (2E)-N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-2-cyano-3-(6-hydroxy-4-oxo-4H-chromen-3-yl)prop-2-enamide
Smiles: N#C/C(=C\c1coc2c(c1=O)cc(cc2)O)/C(=O)/N=c\1/sc2c([nH]1)cccc2

STK586425
Synonyms: 3-(3,4-dimethoxyphenyl)-5-propylpyrazolo[1,5-a]pyrimidin-7-ol
Smiles: CCCc1cc(O)n2c(n1)c(cn2)c1ccc(c(c1)OC)OC

STK586426
Synonyms: 1'-(2,2-dimethoxyethyl)-6-hydroxy-3-(4-methylphenyl)-6'-nitro-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4(3H)-dione
Smiles: COC(CN1CC2(Cc3c1ccc(c3)[N+](=O)[O-])C(=NC(=O)N(C2=O)c1ccc(cc1)C)O)OC

STK586427
Synonyms: (5E)-2-[4-(3-methylphenyl)piperazin-1-yl]-5-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-1,3-thiazol-4(5H)-one
Smiles: Cc1cccc(c1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(o2)c2cccc(c2)C(F)(F)F)/S1

STK586428
Synonyms: 2-(10-chloroanthracen-9-yl)-5-(2,3-dichlorophenyl)-4-phenyl-1H-imidazole
Smiles: Clc1c(Cl)cccc1c1[nH]c(nc1c1ccccc1)c1c2ccccc2c(c2c1cccc2)Cl

STK586430
Synonyms: N-(4-butylphenyl)-2-{[4-(4-methoxyphenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCCCc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)OC)c1ccc(cc1)C

STK586431
Synonyms: 6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-ylN-[(benzyloxy)carbonyl]-D-alaninate
Smiles: O=C(N[C@@H](C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)ccc(c1)Cl)C)OCc1ccccc1

STK586432
Synonyms: N,N-diethyl-2-{[5-(2-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCN(C(=O)CSc1nnc(n1c1ccccc1)c1ccccc1OC)CC

STK586433
Synonyms: N-(3-fluoro-4-methylphenyl)-2-{[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)F)C)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK586434
Synonyms: 8-(4-ethoxyphenyl)-1,7-dimethyl-3-[2-(morpholin-4-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CCOc1ccc(cc1)n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCOCC1

STK586435
Synonyms: 4-chloro-N-methyl-N-(3-sulfanylquinoxalin-2-yl)benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)N(c1nc2ccccc2nc1S)C

STK586436
Synonyms: (4E)-4-{[(3,5-dichlorophenyl)amino]methylidene}-2-phenylisoquinoline-1,3(2H,4H)-dione
Smiles: Clc1cc(N/C=C/2\c3ccccc3C(=O)N(C2=O)c2ccccc2)cc(c1)Cl

STK586438
Synonyms: (2-chloro-6-fluorophenyl)(7-methylidene-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)methanone
Smiles: C=C1c2cc3OCCCOc3cc2CCN1C(=O)c1c(F)cccc1Cl

STK586440
Synonyms: 2-{[4-(4-chlorophenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cc(cc1C)C)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK586441
Synonyms: N-(2-methoxyphenyl)-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccccc1NC(=O)CSc1nnc(n1c1ccccc1)c1cnccn1

STK586443
Synonyms: N-(2-hydroxyethyl)-5,11-dimethyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: OCCNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1C(C)CCC2

STK586444
Synonyms: N-(3,4-dimethoxyphenyl)-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cc(ccc1OC)NC(=O)CSc1nnc(n1c1ccccc1)c1cnccn1

STK586446
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,4-difluorophenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)F)F)nnc1COc1ccc(cc1)Cl

STK586447
Synonyms: N-(3-methylphenyl)-2-[(2-methyl-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidin-7-yl)sulfanyl]acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nnc2n1c1sc3c(c1c1n2nc(n1)C)CCCC3

STK586448
Synonyms: N-(2,5-dimethylphenyl)-5-(2-hydroxy-4-methylphenyl)-1H-pyrazole-3-carboxamide
Smiles: Cc1ccc(c(c1)O)c1[nH]nc(c1)C(=O)Nc1cc(C)ccc1C

STK586452
Synonyms: 3-tert-butyl-7-(5-chloro-2-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Clc1ccc(c(c1)n1ncc2c1ncn1c2nnc1C(C)(C)C)C

STK586453
Synonyms: (2Z)-2-[(5-methylfuran-2-yl)methylidene]-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: Cc1ccc(o1)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCOCC1)[O-]

STK586454
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(2,5-dichlorophenyl)-5-ethyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: CCc1ccc2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(Cl)ccc1Cl

STK586455
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[4-(4-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CSc1nnc(n1c1ccc(cc1)C)c1cnccn1

STK586457
Synonyms: 2-{[5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-fluoro-4-methylphenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)F)C)CSc1nnc(n1C)c1cccc(c1)Cl

STK586458
Synonyms: 1-(2-hydroxyethyl)-2-imino-10-methyl-3-(phenylsulfonyl)-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Smiles: OCCn1c2nc3c(C)cccn3c(=O)c2cc(c1=N)S(=O)(=O)c1ccccc1

STK586459
Synonyms: (5Z)-1-(2,3-dichlorophenyl)-5-{[2,5-dimethyl-1-(quinolin-6-yl)-1H-pyrrol-3-yl]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C\c1cc(n(c1C)c1ccc2c(c1)cccn2)C)c1cccc(c1Cl)Cl

STK586460
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[2-(propan-2-yl)phenyl]acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2C(C)C)nnc1COc1ccc(cc1)Cl

STK586461
Synonyms: (5E)-5-{[(1-benzylpiperidin-4-yl)amino]methylidene}-2-sulfanyl-1-[3-(trifluoromethyl)phenyl]pyrimidine-4,6(1H,5H)-dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/NC1CCN(CC1)Cc1ccccc1)c1cccc(c1)C(F)(F)F

STK586463
Synonyms: 6-chloro-2-oxo-4-propyl-2H-chromen-7-ylN-[(benzyloxy)carbonyl]norvalinate
Smiles: CCCC(C(=O)Oc1cc2oc(=O)cc(c2cc1Cl)CCC)NC(=O)OCc1ccccc1

STK586464
Synonyms: 3-(1H-benzimidazol-2-yl)-N-(3-methoxypropyl)propanamide
Smiles: COCCCNC(=O)CCc1nc2c([nH]1)cccc2

STK586465
Synonyms: [4-amino-3-(2-methoxyethyl)-2-thioxo-2,3-dihydro-1,3-thiazol-5-yl](pyrrolidin-1-yl)methanone
Smiles: COCCn1c(=S)sc(c1N)C(=O)N1CCCC1

STK586467
Synonyms: N-[(2S)-1-[(4-methoxyphenyl)amino]-4-(methylsulfanyl)-1-oxobutan-2-yl]-1-[(4-methylphenyl)sulfonyl]piperidine-4-carboxamide
Smiles: CSCC[C@@H](C(=O)Nc1ccc(cc1)OC)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C

STK586469
Synonyms: (E)-{2-(4-bromophenyl)-1-[4-(dimethylammonio)phenyl]-4,5-dioxopyrrolidin-3-ylidene}(4-chlorophenyl)methanolate
Smiles: Brc1ccc(cc1)C1/C(=C(/c2ccc(cc2)Cl)\[O-])/C(=O)C(=O)N1c1ccc(cc1)[NH+](C)C

STK586470
Synonyms: 3'-(4-chlorophenyl)-6'-hydroxy-2,4-dimethyl-8-nitro-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4'(3'H)-dione
Smiles: CC1OC(C)C2N(C1)c1ccc(cc1CC12C(=NC(=O)N(C1=O)c1ccc(cc1)Cl)O)[N+](=O)[O-]

STK586473
Synonyms: 6-chloro-4-ethyl-9-(pyridin-4-ylmethyl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: CCc1cc(=O)oc2c1cc(Cl)c1c2CN(CO1)Cc1ccncc1

STK586474
Synonyms: 2-[(3-benzyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]-N-cyclopropylacetamide
Smiles: O=C(NC1CC1)COc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1

STK586477
Synonyms: 8-(3,5-dimethylphenyl)-1,6,7-trimethyl-3-[2-(piperidin-1-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cc1cc(C)cc(c1)n1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)CCN1CCCCC1

STK586478
Synonyms: (5Z)-5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-6-hydroxy-3-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
Smiles: C=CCN1C(=O)N=C(/C(=C/Nc2ccc3c(c2)CC2(C4N3CCN(C4)C)C(=NC(=NC2=O)O)O)/C1=O)O

STK586479
Synonyms: 2-[(6-chloro-2-oxo-4-propyl-2H-chromen-7-yl)oxy]-N-(pyridin-2-ylmethyl)propanamide
Smiles: CCCc1cc(=O)oc2c1cc(Cl)c(c2)OC(C(=O)NCc1ccccn1)C

STK586481
Synonyms: 5-[3-(benzyloxy)phenyl]-N'-[(1Z)-1-(4-chlorophenyl)ethylidene]-1H-pyrazole-3-carbohydrazide
Smiles: Clc1ccc(cc1)/C(=N\NC(=O)c1n[nH]c(c1)c1cccc(c1)OCc1ccccc1)/C

STK586483
Synonyms: 2-(3,4-dichlorophenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline
Smiles: COc1cc2CCn3c(c2cc1OC)cc(c3)c1ccc(c(c1)Cl)Cl

STK586486
Synonyms: 1-(3-chlorophenyl)-6-(prop-2-en-1-yl)-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: C=CCN1CNc2c(C1)c(=O)nc(n2c1cccc(c1)Cl)S

STK586487
Synonyms: N-(4-bromo-2-methylphenyl)-2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2C)Br)nnc1COc1ccc(cc1)Cl

STK586488
Synonyms: (3R,3'S,3a'S,6a'R)-5'-(3-chloro-4-fluorophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CC([C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(c(c1)Cl)F)C(=O)Nc1c2cccc1)C

STK586489
Synonyms: N-(4-chlorophenyl)-2-{[10,10-dimethyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetamide
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)Nc1ccc(cc1)Cl)nn2)CC(OC3)(C)C

STK586490
Synonyms: 2-({4-amino-5-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-fluorophenyl)acetamide
Smiles: O=C(Nc1ccccc1F)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK586491
Synonyms: methylN-{[2-(trifluoromethyl)phenyl]carbamoyl}-D-phenylalaninate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccccc1C(F)(F)F)Cc1ccccc1

STK586492
Synonyms: 4-(benzyloxy)-N-[(5Z)-5-(2,5-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide
Smiles: COc1ccc(c(c1)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)OCc1ccccc1)OC

STK586494
Synonyms: 8-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cccc(c1)Cn1c(CN2CCN(CC2)c2cccc(c2)Cl)nc2c1c(=O)n(c(=O)n2C)C

STK586495
Synonyms: 4-({4-chloro-N-[3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]phenylalanyl}amino)butanoicacid
Smiles: O=C(NC(C(=O)NCCCC(=O)O)Cc1ccc(cc1)Cl)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1C)C

STK586496
Synonyms: 2-{[4-(4-chlorophenyl)-3-cyano-5-hydroxy-7,7-dimethyl-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C2=C(CC(CC2=N1)(C)C)O)c1ccc(cc1)Cl

STK586497
Synonyms: N-[(3-bromophenyl)carbamoyl]-L-phenylalanine
Smiles: O=C(N[C@H](C(=O)O)Cc1ccccc1)Nc1cccc(c1)Br

STK586499
Synonyms: 7-ethoxy-9-(methylsulfanyl)-4-(propan-2-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCOc1nc(SC)nc2c1sc1c2c2CCCc2c(n1)C(C)C

STK586503
Synonyms: 2-(2-bromophenyl)-12-(3,4-dimethoxyphenyl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol
Smiles: COc1ccc(cc1OC)C1c2ccc(cc2Oc2c1c1nc(nn1cn2)c1ccccc1Br)O

STK586504
Synonyms: N-(3-fluoro-4-methylphenyl)-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)F)C)CSc1nnc(n1c1ccccc1)c1nccnc1

STK586506
Synonyms: 2-[2-(3,4-dimethoxyphenyl)-8,9-diphenyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl]ethanol
Smiles: OCCn1c(c2ccccc2)c(c2c1ncn1c2nc(n1)c1ccc(c(c1)OC)OC)c1ccccc1

STK586508
Synonyms: 2-{[4-(4-chlorophenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-fluorophenyl)acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2F)nnc1COc1ccccc1

STK586510
Synonyms: N-(4-methylphenyl)-2-[(11-methyl-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidin-7-yl)sulfanyl]acetamide
Smiles: CC1CCc2c(C1)sc1c2c2ncnn2c2n1c(SCC(=O)Nc1ccc(cc1)C)nn2

STK586511
Synonyms: N-(4-methoxyphenyl)-2-{[4-(4-methylphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccccn1

STK586513
Synonyms: (2'S,3S,3'S,10b'R)-3'-{[4-(propan-2-yloxy)phenyl]carbonyl}-2'-[(4-propylphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CCCc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)OC(C)C)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK586514
Synonyms: 2-(3-methoxyphenyl)-10-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1cccc(c1)c1nn2c(n1)c1c(nc2)sc2c1CC(C)CC2

STK586515
Synonyms: N-(3-chloro-4-methylphenyl)-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)ethanediamide
Smiles: O=C(C(=O)NCC1COc2c(O1)cccc2)Nc1ccc(c(c1)Cl)C

STK586516
Synonyms: methyl5-acetyl-2-({(Z)-2-cyano-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]ethenyl}amino)-4-methylthiophene-3-carboxylate
Smiles: N#C/C(=C/Nc1sc(c(c1C(=O)OC)C)C(=O)C)/c1scc(n1)c1cc2ccccc2oc1=O

STK586517
Synonyms: N-(3-chlorophenyl)-2-{[5-(3-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)Cl)nnc1c1cccc(c1)Cl

STK586518
Synonyms: 2-hydroxy-3-{[(E)-(4-hydroxyphenyl)methylidene]amino}-7-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)[nH]c1c2nc(n(c1=O)/N=C/c1ccc(cc1)O)O

STK586519
Synonyms: (4E)-2-(3,4-dimethylphenyl)-4-({[(1-ethylpyrrolidin-2-yl)methyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: CCN1CCCC1CN/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccc(c(c1)C)C

STK586520
Synonyms: N-(4-chlorophenyl)-2-{[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1nnc(n1Cc1ccco1)COc1ccccc1

STK586521
Synonyms: N-[(2Z)-3-(5-chloro-2,4-dimethoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methoxyacetamide
Smiles: COCC(=O)/N=C/1\SC2C(N1c1cc(Cl)c(cc1OC)OC)CS(=O)(=O)C2

STK586522
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{1-ethyl-1'-[2-(morpholin-4-ium-4-yl)ethyl]-2,4',5'-trioxo-1,2-dihydro-3'H-spiro[indole-3,2'-pyrrolidin]-3'-ylidene}methanolate
Smiles: CCN1c2ccccc2C2(C1=O)/C(=C(/c1ccc3c(c1)OCCO3)\[O-])/C(=O)C(=O)N2CC[NH+]1CCOCC1

STK586523
Synonyms: 4-bromo-N-[(3E)-1-ethyl-8-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzenesulfonamide
Smiles: CCn1[nH]/c(=N/S(=O)(=O)c2ccc(cc2)Br)/c2c1nc1c(C)cccc1c2

STK586524
Synonyms: 2,3-diphenyl-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: O=c1n(c2ccccc2)c(nc2c1c(=O)c1c(o2)cccc1)c1ccccc1

STK586525
Synonyms: (3R,3'S,3a'S,6a'R)-5'-(2,3-dichlorophenyl)-3'-[2-(methylsulfanyl)ethyl]-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CSCC[C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1cccc(c1Cl)Cl)C(=O)Nc1c2cccc1

STK586526
Synonyms: (2S)-N-(2-fluorophenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide
Smiles: Fc1ccccc1NC(=O)[C@@H](n1c(O)nc2c(c1=O)cccc2)C

STK586527
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4-difluorophenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2F)F)nnc1COc1ccc(cc1)Cl

STK586528
Synonyms: 2-imino-1,10-dimethyl-N-(2-methylpropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Smiles: CC(CNC(=O)c1cc2c(n(c1=N)C)nc1n(c2=O)cccc1C)C

STK586529
Synonyms: 4-({N-[(3-tert-butyl-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]-L-isoleucyl}amino)butanoicacid
Smiles: CC[C@H]([C@@H](C(=O)NCCCC(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1C(C)(C)C)C

STK586531
Synonyms: 1-hydroxy-5-methyl-9-oxo-9H-xanthen-3-yl(2S)-{[(benzyloxy)carbonyl]amino}(phenyl)ethanoate
Smiles: O=C(N[C@@H](c1ccccc1)C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1C)OCc1ccccc1

STK586532
Synonyms: 5-(2-methoxyphenyl)-4-{[(E)-(4-methylphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C

STK586533
Synonyms: (E)-{2-(2,5-dimethoxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}[3-fluoro-4-(propan-2-yloxy)phenyl]methanolate
Smiles: COc1ccc(c(c1)C1/C(=C(/c2ccc(c(c2)F)OC(C)C)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1)OC

STK586534
Synonyms: 3-(2-ethoxyethyl)-1-methyl-8-(2-methylphenyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: CCOCCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccccc1C

STK586535
Synonyms: 7-(2-chloro-6-fluorobenzyl)-8-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCN1CCN(CC1)Cc1nc2c(n1Cc1c(F)cccc1Cl)c(=O)n(c(=O)n2C)C

STK586538
Synonyms: 6-chloro-N-[(2Z)-6-fluoro-1,3-benzothiazol-2(3H)-ylidene]-7-methyl-4-oxo-4H-chromene-2-carboxamide
Smiles: Fc1ccc2c(c1)s/c(=N\C(=O)c1cc(=O)c3c(o1)cc(c(c3)Cl)C)/[nH]2

STK586541
Synonyms: 1-[(2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)amino]propan-2-ol
Smiles: CC(CNc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C)O

STK586542
Synonyms: (3aS,4R,4aS,7aR,8R,8aS)-6-(4-chlorophenyl)-3-(4-methoxyphenyl)-4a,7a,8,8a-tetrahydro-3aH-4,8-epoxy[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: COc1ccc(cc1)C1=NO[C@H]2[C@@H]1[C@@H]1O[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)Cl

STK586543
Synonyms: 10-methyl-N-[3-(propan-2-yloxy)propyl]-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: CC1CCc2c(C1)c1c(s2)ncn2c1nc(n2)C(=O)NCCCOC(C)C

STK586546
Synonyms: 8-(2-aminophenyl)-4-hydroxy-1,7-dimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: Nc1ccccc1n1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK586549
Synonyms: ethyl5-methyl-4-phenyl-2-[(pyrrolidin-1-ylacetyl)amino]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CN2CCCC2)sc(c1c1ccccc1)C

STK586550
Synonyms: 6-(3-fluorobenzyl)-9-methoxy-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-5(6H)-one
Smiles: COc1ccc2c(c1)c1nc3SCCn3c(=O)c1n2Cc1cccc(c1)F

STK586551
Synonyms: 2-{[3-cyano-6-hydroxy-4-(2-methylphenyl)-4,5-dihydropyridin-2-yl]sulfanyl}-N-(4-nitrophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)[N+](=O)[O-])N=C(CC1c1ccccc1C)O

STK586552
Synonyms: N-[4-({(1E)-1-[4-hydroxy-1-(2-methylphenyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]ethyl}amino)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)N/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1C)O)/C

STK586553
Synonyms: N-[3-(3,4-dichlorophenyl)-1-methyl-4-oxo-1,4-dihydroquinolin-2-yl]butanamide
Smiles: CCCC(=O)Nc1c(c2ccc(c(c2)Cl)Cl)c(=O)c2c(n1C)cccc2

STK586554
Synonyms: N-(4-nitrophenyl)-6-(4-oxoquinazolin-3(4H)-yl)hexanamide
Smiles: O=C(Nc1ccc(cc1)[N+](=O)[O-])CCCCCn1cnc2c(c1=O)cccc2

STK586555
Synonyms: 8-[(2E)-2-(2-chloro-6-fluorobenzylidene)hydrazinyl]-7-ethyl-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CCn1c(N/N=C/c2c(F)cccc2Cl)nc2c1c(O)nc(=O)n2C

STK586556
Synonyms: 8-(azepanium-1-ylmethyl)-3-(naphthalen-2-yloxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate
Smiles: [O-]c1ccc2c(c1C[NH+]1CCCCCC1)oc(c(c2=O)Oc1ccc2c(c1)cccc2)C(F)(F)F

STK586557
Synonyms: 2-{[4-ethyl-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-phenoxyphenyl)acetamide
Smiles: COc1cccc(c1)c1nnc(n1CC)SCC(=O)Nc1ccc(cc1)Oc1ccccc1

STK586559
Synonyms: 2-{[4-amino-5-(5-phenyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-dichlorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)CSc1nnc(n1N)c1n[nH]c(c1)c1ccccc1

STK586560
Synonyms: (4E)-4-[hydroxy(5-methylfuran-2-yl)methylidene]-1-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-phenylpyrrolidine-2,3-dione
Smiles: CSc1nnc(s1)N1C(=O)C(=O)/C(=C(\c2ccc(o2)C)/O)/C1c1ccccc1

STK586562
Synonyms: 4-({[5-(3-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Smiles: N#Cc1ccc(cc1)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK586563
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(3-nitrophenyl)carbonyl]-3'-(thiophen-2-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: O=C([C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cccc(c1)[N+](=O)[O-])C(=O)Nc1c2cccc1)cccc3)c1cccs1

STK586566
Synonyms: ethyl2-[1-(2-fluorophenyl)-3,9-dioxo-3,9-dihydrochromeno[2,3-c]pyrrol-2(1H)-yl]-1,3-benzothiazole-6-carboxylate
Smiles: CCOC(=O)c1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccccc1F)c(=O)c1c(o2)cccc1

STK586567
Synonyms: 3-(1,3-benzothiazol-2-yl)-4-oxo-8-(pyrrolidinium-1-ylmethyl)-4H-chromen-7-olate
Smiles: [O-]c1ccc2c(c1C[NH+]1CCCC1)occ(c2=O)c1nc2c(s1)cccc2

STK586568
Synonyms: 2-(azepan-1-yl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-carbaldehyde
Smiles: O=Cc1c(nc2n(c1=O)cccc2C)N1CCCCCC1

STK586569
Synonyms: 2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-(3-hydroxypropyl)acetamide
Smiles: Cc1c(CC(=O)NCCCO)c(=O)oc2c1cc(Cl)c(c2)OC

STK586571
Synonyms: (3-methoxyphenyl)(3,5,6,7-tetrahydro-1'H-spiro[imidazo[4,5-c]pyridine-4,4'-piperidin]-1'-yl)methanone
Smiles: COc1cccc(c1)C(=O)N1CCC2(CC1)NCCc1c2[nH]cn1

STK586573
Synonyms: N-(3-ethyl-1',3'-dimethyl-2',4',6'-trioxo-1',2,3,3',4,4',4a,6'-octahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide
Smiles: CCN1CCN2C(C1)C1(Cc3c2ccc(c3)NC(=O)C)C(=O)N(C)C(=O)N(C1=O)C

STK586574
Synonyms: 2-(1H-indol-3-yl)-N-[1-(4-methoxyphenyl)-2-phenylethyl]-N-methyl-2-oxoacetamide
Smiles: COc1ccc(cc1)C(N(C(=O)C(=O)c1c[nH]c2c1cccc2)C)Cc1ccccc1

STK586575
Synonyms: 2-(methylsulfanyl)-9-(2,3,4-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CSc1nc2n(n1)C(C1=C(O)CCCC1=N2)c1ccc(c(c1OC)OC)OC

STK586576
Synonyms: 2-(ethylsulfanyl)-5-methyl-6-(naphthalen-1-ylmethyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: CCSc1nn2c(n1)nc(c(c2O)Cc1cccc2c1cccc2)C

STK586578
Synonyms: 2-{[5-(3-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide
Smiles: COc1cc(OC)ccc1NC(=O)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK586580
Synonyms: N-(3,4-difluorophenyl)-2-{[4-(4-methoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)F)F)nnc1c1cccc(c1)C

STK586581
Synonyms: 9-[2-(3,4-dimethoxyphenyl)ethyl]-3-ethyl-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COc1cc(CCN2CCCn3c2nc2c3c(=O)n(c(=O)n2C)CC)ccc1OC

STK586582
Synonyms: (5Z)-5-{[1-(4-bromonaphthalen-1-yl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-3-cyclohexyl-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C/c2cc(n(c2C)c2ccc(c3c2cccc3)Br)C)/C(=O)N1C1CCCCC1

STK586584
Synonyms: (2Z)-N-(4-fluorophenyl)-4-hydroxy-2-[(2E)-(4-methoxybenzylidene)hydrazinylidene]-5,6-dihydro-2H-1,3-thiazine-6-carboxamide
Smiles: COc1ccc(cc1)/C=N/N=C\1/N=C(O)CC(S1)C(=O)Nc1ccc(cc1)F

STK586585
Synonyms: 2-[4-(2-fluorophenyl)piperazin-1-yl]-5-nitrobenzaldehyde
Smiles: O=Cc1cc(ccc1N1CCN(CC1)c1ccccc1F)[N+](=O)[O-]

STK586586
Synonyms: N-[(4-methoxyphenyl)carbamoyl]-L-leucine
Smiles: COc1ccc(cc1)NC(=O)N[C@H](C(=O)O)CC(C)C

STK586588
Synonyms: 2-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methyl-5-(3-methylbutyl)pyrimidin-4-ol
Smiles: COc1ccc(cc1)N1CCN(CC1)c1nc(C)c(c(n1)O)CCC(C)C

STK586589
Synonyms: 2-{[5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(propan-2-yl)phenyl]acetamide
Smiles: CCn1c(SCC(=O)Nc2ccccc2C(C)C)nnc1c1cccc(c1)Cl

STK586592
Synonyms: 2-[(6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy]-N-(pyridin-3-ylmethyl)acetamide
Smiles: O=C(NCc1cccnc1)COc1ccc2c(c1)oc(=O)c1c2CCCC1

STK586593
Synonyms: (5E)-6-hydroxy-3-(2-methylphenyl)-5-[1-(piperidin-1-ylamino)propylidene]pyrimidine-2,4(3H,5H)-dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccccc1C)O)/NN1CCCCC1

STK586594
Synonyms: (E)-[3-fluoro-4-(propan-2-yloxy)phenyl]{1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-(3,4,5-trimethoxyphenyl)pyrrolidin-3-ylidene}methanolate
Smiles: COc1c(OC)cc(cc1OC)C1/C(=C(/c2ccc(c(c2)F)OC(C)C)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1

STK586595
Synonyms: 9-methoxy-6-[2-(pentyloxy)benzyl]-6H-indolo[2,3-b]quinoxaline
Smiles: CCCCCOc1ccccc1Cn1c2ccc(cc2c2c1nc1ccccc1n2)OC

STK586598
Synonyms: 3-cyclohexyl-N-[4-methoxy-3-(propan-2-yloxy)benzyl]-3-[4-(propan-2-yloxy)phenyl]propan-1-amine
Smiles: COc1ccc(cc1OC(C)C)CNCCC(c1ccc(cc1)OC(C)C)C1CCCCC1

STK586600
Synonyms: 2-amino-1-(2-aminoethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile
Smiles: NCCn1c2nc3ccccc3nc2c(c1N)C#N

STK586601
Synonyms: 7-hydroxy-2,5-dimethylpyrazolo[1,5-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1c(C)nn2c1nc(C)cc2O

STK586604
Synonyms: N-[4,6-dioxo-1-(pyridin-2-ylmethyl)-2-sulfanyl-5-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-4-fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)NC1(C(=O)Nc2c1c(=O)nc(n2Cc1ccccn1)S)C(F)(F)F

STK586605
Synonyms: 4-chloro-N-[(2E)-6-methoxy-1,3-benzothiazol-2(3H)-ylidene]-3-nitrobenzamide
Smiles: COc1ccc2c(c1)s/c(=N/C(=O)c1ccc(c(c1)[N+](=O)[O-])Cl)/[nH]2

STK586607
Synonyms: N-(3-chlorophenyl)-4-(4-methylphenyl)-1-[4-(propan-2-yl)phenyl]-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Clc1cccc(c1)NC(=O)c1n2cc(n3c2c(c1c1ccc(cc1)C(C)C)CCCC3)c1ccc(cc1)C

STK586608
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(2-ethoxyphenyl)carbonyl]-3'-[(4-fluorophenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CCOc1ccccc1C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)F)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK586609
Synonyms: N-benzyl-4-methoxy-1H-indole-2-carboxamide
Smiles: COc1cccc2c1cc([nH]2)C(=O)NCc1ccccc1

STK586610
Synonyms: N-(furan-2-ylmethyl)-3-methoxy-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COc1cccc(c1)C(=O)N(Cc1cc2ccc(cc2[nH]c1=O)C)Cc1ccco1

STK586612
Synonyms: [1-(4-chlorophenyl)cyclopentyl](5-methylidene-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-6(5H)-yl)methanone
Smiles: Clc1ccc(cc1)C1(CCCC1)C(=O)N1CCc2c(C1=C)cc1c(c2)OCO1

STK586613
Synonyms: 3-benzyl-3'-tert-butyl-6'-hydroxy-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4'(3'H)-dione
Smiles: O=C1N=C(O)C2(C(=O)N1C(C)(C)C)Cc1ccccc1N1C2CN(CC1)Cc1ccccc1

STK586614
Synonyms: 8-{[benzyl(methyl)ammonio]methyl}-3-(2-bromophenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate
Smiles: C[NH+](Cc1c([O-])ccc2c1oc(c(c2=O)Oc1ccccc1Br)C(F)(F)F)Cc1ccccc1

STK586615
Synonyms: 3,6-diamino-N-(2-chloro-4-fluorophenyl)-5-cyanothieno[2,3-b]pyridine-2-carboxamide
Smiles: N#Cc1cc2c(nc1N)sc(c2N)C(=O)Nc1ccc(cc1Cl)F

STK586617
Synonyms: 5-(4-bromophenyl)-3-(2-hydroxyphenyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylicacid
Smiles: OC(=O)C1NC(C2C1C(=O)N(C2=O)c1ccc(cc1)Br)c1ccccc1O

STK586618
Synonyms: N-(4-butylphenyl)-2-{[4-(4-chlorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCCCc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)OC

STK586622
Synonyms: N'-[(E)-(4-methoxyphenyl)methylidene]-5-[4-(pentyloxy)phenyl]-1H-pyrazole-3-carbohydrazide
Smiles: CCCCCOc1ccc(cc1)c1[nH]nc(c1)C(=O)N/N=C/c1ccc(cc1)OC

STK586623
Synonyms: 8,8-dimethyl-2-(4-nitrophenyl)-5-(pyrrolidin-1-yl)-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridin-1-amine
Smiles: [O-][N+](=O)c1ccc(cc1)c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCCC1

STK586625
Synonyms: 2-(6-chloro-1,3-benzothiazol-2-yl)-1-(pyridin-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Clc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1cccnc1)c(=O)c1c(o2)cccc1

STK586626
Synonyms: 2-{[5-(3-chlorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dichlorophenyl)acetamide
Smiles: O=C(Nc1cc(Cl)ccc1Cl)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK586628
Synonyms: N-{[6-chloro-8-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}-4-phenoxybenzamide
Smiles: Clc1cc(c2n(c1)c(CNC(=O)c1ccc(cc1)Oc1ccccc1)nn2)C(F)(F)F

STK586629
Synonyms: N-benzyl-2-{[2-(3-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)c1nc(SCC(=O)NCc2ccccc2)c2c(n1)CC(OC2)(C)C

STK586630
Synonyms: 4-({(E)-[4-(diethylamino)phenyl]methylidene}amino)-5-(4-fluorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCN(c1ccc(cc1)/C=N/n1c(n[nH]c1=S)c1ccc(cc1)F)CC

STK586631
Synonyms: 1-hydroxy-N-(2-methoxyethyl)-1H-benzimidazole-2-carboxamide3-oxide
Smiles: COCCNC(=O)c1n(O)c2c([n+]1[O-])cccc2

STK586632
Synonyms: 5-(2-bromophenyl)-4-{[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(ccc1O)/C=N/n1c(=S)[nH]nc1c1ccccc1Br

STK586633
Synonyms: 6-chloro-2-oxo-4-propyl-2H-chromen-7-yl2-{[(4-methylphenyl)sulfonyl]amino}butanoate
Smiles: CCCc1cc(=O)oc2c1cc(Cl)c(c2)OC(=O)C(NS(=O)(=O)c1ccc(cc1)C)CC

STK586635
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[4-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1ccc2c(c1)OCCO2

STK586636
Synonyms: (2Z)-7-{[benzyl(methyl)ammonio]methyl}-2-[4-(methoxycarbonyl)benzylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: COC(=O)c1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+](Cc1ccccc1)C)[O-]

STK586637
Synonyms: N-(1,3-dimethyl-2,4,6-trioxo-1,1',2',3,3',3a',4,6-octahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-7'-yl)acetamide
Smiles: CC(=O)Nc1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C

STK586638
Synonyms: (3R,3'S,5'R)-5-chloro-N-(2,5-dimethoxyphenyl)-7-methyl-2-oxo-5'-(propan-2-yl)-1,2-dihydrospiro[indole-3,2'-pyrrolidine]-3'-carboxamide
Smiles: COc1ccc(cc1NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(Cl)cc1C)C(C)C)OC

STK586639
Synonyms: (3a'S,6a'R)-5'-(1,3-benzodioxol-5-ylmethyl)-5-fluoro-3'-(1-hydroxyethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Fc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)Cc1ccc3c(c1)OCO3)C(O)C)C(=O)N2

STK586642
Synonyms: 7-(3,5-dimethyl-1H-pyrazol-1-yl)-2-ethyl-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidine
Smiles: CCc1nn2c(c1c1ccccc1)nc(cc2n1nc(cc1C)C)C

STK586643
Synonyms: 1-(1,3-dimethyl-2,4,6-trioxo-1,1',2',3,3',3a',4,6-octahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-7'-yl)-3-ethylthiourea
Smiles: CCNC(=S)Nc1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C

STK586644
Synonyms: N-[(3Z)-8-methyl-1-propyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-2-nitrobenzenesulfonamide
Smiles: CCCn1[nH]/c(=N\S(=O)(=O)c2ccccc2[N+](=O)[O-])/c2c1nc1c(c2)cccc1C

STK586645
Synonyms: (5E)-5-(1-{[4-(diethylamino)phenyl]amino}propylidene)-6-hydroxy-3-(2-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: CCN(c1ccc(cc1)N/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1C)O)/CC)CC

STK586646
Synonyms: (4Z)-2-(2-chloro-5-nitrophenyl)-4-(3-methoxy-4-propoxybenzylidene)-1,3-oxazol-5(4H)-one
Smiles: CCCOc1ccc(cc1OC)/C=C/1\N=C(OC1=O)c1cc(ccc1Cl)[N+](=O)[O-]

STK586647
Synonyms: 6-[(E)-{(2Z)-[5-(2-{[4-(ethoxycarbonyl)phenyl]amino}-2-oxoethyl)-4-hydroxy-1,3-thiazol-2(5H)-ylidene]hydrazinylidene}methyl]-2,3-dimethoxybenzoicacid
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CC1S/C(=N\N=C\c2ccc(c(c2C(=O)O)OC)OC)/N=C1O

STK586649
Synonyms: 7-chloro-3-ethyl-1',3'-bis(2-methylpropyl)-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CCN1CCN2C(C1)C1(Cc3c2cccc3Cl)C(=O)N(CC(C)C)C(=O)N(C1=O)CC(C)C

STK586651
Synonyms: 6-hydroxy-7-[2-hydroxy-3-(4-methylphenoxy)propyl]-3-methyl-8-(piperazin-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: OC(Cn1c(nc2c1c(O)nc(=O)n2C)N1CCNCC1)COc1ccc(cc1)C

STK586653
Synonyms: 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)cyclohexanone
Smiles: O=C1CCCCC1Sc1ncnc2c1oc1c2cccc1

STK586654
Synonyms: 3-(3-chloro-4-methylphenyl)-2,6-dihydroxy-5-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)pyrimidin-4(3H)-one
Smiles: O=C1OC(c2c1cccc2)c1c(O)nc(n(c1=O)c1ccc(c(c1)Cl)C)O

STK586655
Synonyms: (4-chlorophenyl)(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1ccc(cc1)Cl

STK586656
Synonyms: 5-(2-fluorophenyl)-4-{[(E)-(2-fluorophenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccccc1/C=N/n1c(=S)[nH]nc1c1ccccc1F

STK586658
Synonyms: N-[(2Z)-3-(3,4-dimethoxybenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-ethylbutanamide
Smiles: CCC(C(=O)/N=C/1\SC2C(N1Cc1ccc(c(c1)OC)OC)CS(=O)(=O)C2)CC

STK586660
Synonyms: 6-benzyl-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-ol
Smiles: Cc1nc2n(c(c1Cc1ccccc1)O)ncc2c1ccccc1

STK586665
Synonyms: (3a'S,6a'R)-5'-butyl-7-chloro-3'-(2-methylpropyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(C)C)C(=O)Nc2c1cccc2Cl

STK586666
Synonyms: N-[2-(4-chlorophenyl)-4-(4-methoxyphenyl)-6-methyl-5-oxo-2,5-dihydropyridazin-3-yl]-2-methylpropanamide
Smiles: COc1ccc(cc1)c1c(NC(=O)C(C)C)n(nc(c1=O)C)c1ccc(cc1)Cl

STK586668
Synonyms: ethyl2-({[(2R)-1-methoxy-1-oxopropan-2-yl]carbamoyl}amino)benzoate
Smiles: CCOC(=O)c1ccccc1NC(=O)N[C@@H](C(=O)OC)C

STK586672
Synonyms: methylN-[(2,4-dimethoxyphenyl)carbamoyl]-D-leucinate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccc(cc1OC)OC)CC(C)C

STK586673
Synonyms: 7-chloro-4-(2-methylpropyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
Smiles: CC(Cc1nc2oc3c(c2c2c1CCC2)ncnc3Cl)C

STK586674
Synonyms: 3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]quinazolin-4(3H)-one
Smiles: O=C(N1CCC(CC1)Cc1ccccc1)Cn1cnc2c(c1=O)cccc2

STK586675
Synonyms: (4E)-5-(4-bromophenyl)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(4-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1ccc(cc1)Br

STK586676
Synonyms: 8-(2-methoxyphenyl)-1-methyl-3-(2-methylbenzyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COc1ccccc1N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1C

STK586677
Synonyms: 2,8,10-trimethyl-4-(4-methylpiperazin-1-yl)pyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidine
Smiles: CN1CCN(CC1)c1cc(C)nc2n1nc1c2c(C)cc(n1)C

STK586678
Synonyms: 1-(3,4-dimethylphenyl)-N-(4-methoxyphenyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1c(c2ccc(c(c2)C)C)c2c3n1cc(n3CCCC2)c1ccc(cc1)C

STK586680
Synonyms: (3a'R,8b'S)-2'-tert-butyl-7-chloro-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: O=C1[C@@H]2C3CCCN3C3([C@@H]2C(=O)N1C(C)(C)C)C(=O)Nc1c3cccc1Cl

STK586681
Synonyms: 6,7-dimethoxy-2-[(4-methoxyphenyl)sulfonyl]-1-methyl-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCc2c(C1C)cc(c(c2)OC)OC

STK586683
Synonyms: 9a-[(E)-2-{4-[(2,4-dichlorobenzyl)oxy]-3-ethoxyphenyl}ethenyl]-7,9,9-trimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one
Smiles: CCOc1cc(ccc1OCc1ccc(cc1Cl)Cl)/C=C/C12NC(=O)CN1c1c(C2(C)C)cc(cc1)C

STK586684
Synonyms: N-(2-tert-butylphenyl)-2-{[4-(4-methoxyphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(C)(C)C)nnc1c1ccccn1

STK586686
Synonyms: 2-(2,4-dibromophenoxy)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one
Smiles: COc1cc2c(cc1OC)CCn1c2cc(Oc2ccc(cc2Br)Br)nc1=O

STK586687
Synonyms: N-(3-chlorophenyl)-2-{[4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)Cl)nnc1COc1ccccc1

STK586688
Synonyms: 9-(4-ethylphenyl)-1-methyl-3-[2-(piperidin-1-yl)ethyl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCCCC1

STK586690
Synonyms: 6-benzyl-2-(benzylsulfanyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: Cc1nc2nc(nn2c(c1Cc1ccccc1)O)SCc1ccccc1

STK586691
Synonyms: N-[4-(benzyloxy)phenyl]-2-{[5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)OCc1ccccc1)CSc1nnc(n1C)c1cccc(c1)Cl

STK586694
Synonyms: (E)-(4-fluorophenyl){2-(4-hydroxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: Oc1ccc(cc1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)F)/[O-]

STK586696
Synonyms: (5E)-3-(4-chlorophenyl)-5-{1-[(2,5-dimethoxyphenyl)amino]propylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)Cl)O)/Nc1cc(OC)ccc1OC

STK586702
Synonyms: (2-benzylphenyl)(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1ccccc1Cc1ccccc1

STK586703
Synonyms: N-[3-(2-chlorophenyl)-1-ethyl-4-oxo-1,4-dihydroquinolin-2-yl]furan-2-carboxamide
Smiles: CCn1c(NC(=O)c2ccco2)c(c2ccccc2Cl)c(=O)c2c1cccc2

STK586704
Synonyms: 2-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-methylacetamide
Smiles: O=C(N(C1CCS(=O)(=O)C1)C)CN1C(=O)c2c(S1(=O)=O)cccc2

STK586705
Synonyms: 1-(4-ethylphenyl)-N-(2-methoxyphenyl)-4-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCc1ccc(cc1)c1c(C(=O)Nc2ccccc2OC)n2c3c1CCCCn3c(c2)c1ccc(cc1)OC

STK586706
Synonyms: 4-{[(E)-(2-nitrophenyl)methylidene]amino}-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1ccccc1[N+](=O)[O-]

STK586708
Synonyms: 2-chloro-N-(1,1-dioxido-2,3-dihydrothiophen-3-yl)acetamide
Smiles: ClCC(=O)NC1C=CS(=O)(=O)C1

STK586709
Synonyms: (5Z)-5-(3,4-dimethoxybenzylidene)-2-methyl-3-(naphthalen-2-yl)-3,5-dihydro-4H-imidazol-4-one
Smiles: COc1ccc(cc1OC)/C=C/1\N=C(N(C1=O)c1ccc2c(c1)cccc2)C

STK586710
Synonyms: N'-[1-(2,2-dimethyl-4-phenyltetrahydro-2H-pyran-4-yl)propan-2-yl]-N,N-diethylpropane-1,3-diamine
Smiles: CCN(CCCNC(CC1(CCOC(C1)(C)C)c1ccccc1)C)CC

STK586711
Synonyms: 6-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-(3-methylbutyl)hexanamide
Smiles: CC(CCNC(=O)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)C

STK586713
Synonyms: (5-methylidene-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-6(5H)-yl)[4-(piperidin-1-ylsulfonyl)phenyl]methanone
Smiles: O=C(N1CCc2c(C1=C)cc1c(c2)OCO1)c1ccc(cc1)S(=O)(=O)N1CCCCC1

STK586720
Synonyms: (3E)-3-(furan-2-ylmethylidene)-4-imino-8-(methylsulfonyl)-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-2-one
Smiles: O=C1N=c2sc3c(n2C(=N)/C/1=C\c1ccco1)ccc(c3)S(=O)(=O)C

STK586721
Synonyms: 4-(2,3-dichlorophenyl)-2-(ethylsulfanyl)-5-hydroxy-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: CCSC1=C(C#N)C(C2=C(CCCC2=N1)O)c1cccc(c1Cl)Cl

STK586722
Synonyms: 4-[7-(4-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]phenol
Smiles: Cc1ccc(cc1)n1ncc2c1ncn1c2nnc1c1ccc(cc1)O

STK586723
Synonyms: (2Z)-1-(4-chlorophenyl)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)ethanone
Smiles: COc1cc2/C(=C/C(=O)c3ccc(cc3)Cl)/NCCc2cc1OC

STK586727
Synonyms: 8-(3-chlorophenyl)-9-(5-methyl-1,2-oxazol-3-yl)-8,9-dihydrobenzo[7,8]chromeno[2,3-c]pyrrole-7,10-dione
Smiles: Clc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)c2ccccc2cc1

STK586728
Synonyms: 3-chloro-N-(3-methyl-1-phenyl-1H-pyrazol-5-yl)quinoxalin-2-amine
Smiles: Cc1cc(n(n1)c1ccccc1)Nc1nc2ccccc2nc1Cl

STK586731
Synonyms: (4E)-5-[4-(benzyloxy)-3-ethoxyphenyl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-{5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1OCc1ccccc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nnc(s1)SCc1ccc(cc1)C

STK586732
Synonyms: 2-{5-[(3,4-dimethylbenzyl)sulfanyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}pyrazine
Smiles: Cc1ccc(cc1)n1c(SCc2ccc(c(c2)C)C)nnc1c1nccnc1

STK586735
Synonyms: (3S,3'S,3a'R,6a'S)-5-chloro-3'-(3,4-dihydroxybenzyl)-7-methyl-5'-(tetrahydrofuran-2-ylmethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Clc1cc(C)c2c(c1)[C@]1(N[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)CC1CCCO1)Cc1ccc(c(c1)O)O)C(=O)N2

STK586736
Synonyms: 2-{[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc(n1Cc1ccco1)COc1ccccc1

STK586737
Synonyms: 2-(2-chlorophenyl)-3-(4-fluorophenyl)-10-methylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: Fc1ccc(cc1)n1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1ccccc1Cl

STK586738
Synonyms: 3-{(Z)-[3-(3-methoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-7-methyl-2-(4-phenylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: COCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2)/C1=O

STK586739
Synonyms: 1,3-dimethyl-7-(3-methylbutyl)-8-[(2-methylpiperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCn1c(CN2CCCCC2C)nc2c1c(=O)n(c(=O)n2C)C)C

STK586741
Synonyms: ethyl2-amino-5'-fluoro-1'-methyl-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[chromene-4,3'-indole]-3-carboxylate
Smiles: CCOC(=O)C1=C(N)OC2=C(C31C(=O)N(c1c3cc(F)cc1)C)C(=O)CCC2

STK586742
Synonyms: 1'-cyclohexyl-9-methyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[benzo[g]pyrido[1,2-a][1,8]naphthyridine-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: Cc1ccc2c(c1)cc1c(n2)N2CCCCC2C2(C1)C(=O)NC(=O)N(C2=O)C1CCCCC1

STK586743
Synonyms: 10-methoxy-7-(3-nitrobenzyl)-3,4-dihydro-2H-[1,3]thiazino[3',2':1,2]pyrimido[5,4-b]indol-6(7H)-one
Smiles: COc1ccc2c(c1)c1nc3SCCCn3c(=O)c1n2Cc1cccc(c1)[N+](=O)[O-]

STK586744
Synonyms: 12-chloro-3-(tetrahydrofuran-2-ylmethyl)-3,4,7,8,9,10-hexahydro-2H,6H-benzo[3,4]chromeno[8,7-e][1,3]oxazin-6-one
Smiles: Clc1cc2c(c3c1OCN(C3)CC1CCCO1)oc(=O)c1c2CCCC1

STK586745
Synonyms: N'-[(1Z)-3-amino-1H-isoindol-1-ylidene]tricyclo[3.3.1.1~3,7~]decane-1-carbohydrazide
Smiles: O=C(C12CC3CC(C2)CC(C1)C3)N/N=C/1\N=C(c2c1cccc2)N

STK586747
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-{5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-(3-hydroxyphenyl)pyrrolidine-2,3-dione
Smiles: Oc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2)F)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK586748
Synonyms: 5-(4-tert-butylphenyl)-6-(1-hydroxy-2-methylpropan-2-yl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: OCC(n1cc2c(c1c1ccc(cc1)C(C)(C)C)c(=O)n(c(=O)n2C)C)(C)C

STK586751
Synonyms: 4-{[(E)-(3-fluorophenyl)methylidene]amino}-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1cccc(c1)/C=N/n1c(=S)[nH]nc1c1ccccc1C

STK586752
Synonyms: 4-methyl-1'-(2-methylphenyl)-3,4-dihydro-1H,2'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CN1CC2(Cc3c1ccc1c3cccc1)C(=O)NC(=O)N(C2=O)c1ccccc1C

STK586753
Synonyms: 4-[(4-{(5Z)-2,4-dioxo-5-[(2E)-3-phenylprop-2-en-1-ylidene]-1,3-thiazolidin-3-yl}butanoyl)amino]benzoicacid
Smiles: O=C(Nc1ccc(cc1)C(=O)O)CCCN1C(=O)S/C(=C\C=C\c2ccccc2)/C1=O

STK586754
Synonyms: 2-({4-(4-ethoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)C(F)(F)F)nnc1COc1ccc(cc1)C

STK586755
Synonyms: 5-(2-chlorophenyl)-4-({(E)-[2-(trifluoromethyl)phenyl]methylidene}amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccccc1C(F)(F)F

STK586756
Synonyms: (3S,3'S,3a'R,6a'S)-3'-(propan-2-yl)-5'-(prop-2-en-1-yl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: C=CCN1C(=O)[C@@H]2[C@H](C1=O)[C@@]1(N[C@H]2C(C)C)C(=O)Nc2c1cccc2

STK586757
Synonyms: (3a'S,6a'R)-5-fluoro-5'-(2-methoxyethyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(C)C)C(=O)Nc2c1cc(F)cc2

STK586758
Synonyms: 2-(10-methoxy-6-oxo-3,4-dihydro-2H-[1,3]thiazino[3',2':1,2]pyrimido[5,4-b]indol-7(6H)-yl)-N-(2-phenylethyl)acetamide
Smiles: COc1ccc2c(c1)c1nc3SCCCn3c(=O)c1n2CC(=O)NCCc1ccccc1

STK586759
Synonyms: (4Z)-2-(4-chlorophenyl)-4-[2-(4-methoxyphenyl)-4H-chromen-4-ylidene]-1,3-oxazol-5(4H)-one
Smiles: COc1ccc(cc1)C1=C/C(=C\2/N=C(OC2=O)c2ccc(cc2)Cl)/c2c(O1)cccc2

STK586760
Synonyms: 2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-ylN-(tert-butoxycarbonyl)norvalinate
Smiles: CCCC(C(=O)Oc1cc2oc(=O)c3c(c2cc1Cl)CCCC3)NC(=O)OC(C)(C)C

STK586763
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-ethylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2CC)nnc1COc1ccc(cc1)Cl

STK586766
Synonyms: 2-(ethylsulfanyl)-5-hydroxy-4-[4-(propan-2-yl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: CCSC1=C(C#N)C(C2=C(CCCC2=N1)O)c1ccc(cc1)C(C)C

STK586767
Synonyms: 3-benzyl-2-(2-chlorophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: Clc1ccccc1c1nc2oc3ccccc3c(=O)c2c(=O)n1Cc1ccccc1

STK586768
Synonyms: N-(2,5-dimethylphenyl)-2,2-dimethyl-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]propanamide
Smiles: Cc1ccc(c(c1)N(C(=O)C(C)(C)C)Cc1cc2cccc(c2[nH]c1=O)C)C

STK586769
Synonyms: 8-[(2-fluorophenyl)sulfonyl]-7-methyl-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Smiles: CC1c2cc3OCCCOc3cc2CCN1S(=O)(=O)c1ccccc1F

STK586770
Synonyms: 3'-tert-butyl-6'-hydroxy-3-methyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4'(3'H)-dione
Smiles: CN1CCN2C(C1)C1(Cc3c2cccc3)C(=NC(=O)N(C1=O)C(C)(C)C)O

STK586771
Synonyms: 2-(6-ethoxy-1,3-benzothiazol-2-yl)-7-methyl-1-phenyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccccc1)c(=O)c1c(o2)ccc(c1)C

STK586773
Synonyms: 2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(3-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1cc(C)c2c(c1)sc(n2)N1C(=O)c2c(C1c1cccc(c1)[N+](=O)[O-])c(=O)c1c(o2)cccc1

STK586774
Synonyms: 7-fluoro-2-(6-methyl-1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1ccc(cc1)C1N(c2sc3c(n2)ccc(c3)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK586775
Synonyms: 3-[(3a'S,6a'R)-7-chloro-5'-(2-methoxyethyl)-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]propanamide
Smiles: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CCC(=O)N)C(=O)Nc2c1cccc2Cl

STK586776
Synonyms: 4-{[(E)-(3-bromo-4-methoxyphenyl)methylidene]amino}-5-(3-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(c(c1)Br)OC

STK586778
Synonyms: 6-hydroxy-3-methyl-7-(2-methylprop-2-en-1-yl)-8-(propan-2-ylsulfanyl)-3,7-dihydro-2H-purin-2-one
Smiles: CC(=C)Cn1c(SC(C)C)nc2c1c(O)nc(=O)n2C

STK586779
Synonyms: 4-{[(E)-(4-chloro-3-nitrophenyl)methylidene]amino}-5-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: [O-][N+](=O)c1cc(ccc1Cl)/C=N/n1c(=S)[nH]nc1c1ccccc1

STK586780
Synonyms: 2-(2-{[4-(2-methylpropyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-7-yl]amino}ethoxy)ethanol
Smiles: OCCOCCNc1ncnc2c1oc1c2c2CCCc2c(n1)CC(C)C

STK586781
Synonyms: 5-(3-ethoxyphenyl)-4-{[(E)-(4-methoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)OC

STK586782
Synonyms: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl](6-methoxy-1H-indol-2-yl)methanone
Smiles: COc1ccc2c(c1)[nH]c(c2)C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK586783
Synonyms: N-[3-(2-methoxyphenyl)-1-methyl-4-oxo-1,4-dihydroquinolin-2-yl]butanamide
Smiles: CCCC(=O)Nc1n(C)c2ccccc2c(=O)c1c1ccccc1OC

STK586784
Synonyms: (4E)-5-(3,4-dimethoxyphenyl)-4-{hydroxy[4-(2-methylpropoxy)phenyl]methylidene}-1-(2-methoxyethyl)pyrrolidine-2,3-dione
Smiles: COCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)OCC(C)C)/O)/C1c1ccc(c(c1)OC)OC

STK586785
Synonyms: (E)-{2-[4-(benzyloxy)-3-ethoxyphenyl]-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Smiles: CCOc1cc(ccc1OCc1ccccc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CC[NH+](C)C

STK586787
Synonyms: 2-(9-methoxy-5-oxo-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-6(5H)-yl)-N-(3-methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)Cn1c2ccc(cc2c2c1c(=O)n1CCSc1n2)OC

STK586788
Synonyms: N,N-dimethyl-N'-[4-(2-methylpropyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-7-yl]ethane-1,2-diamine
Smiles: CC(Cc1nc2oc3c(c2c2c1CCC2)ncnc3NCCN(C)C)C

STK586790
Synonyms: 2,2-dimethyl-8-(piperazin-1-yl)-5-(propan-2-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
Smiles: CC(c1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3N1CCNCC1)C

STK586791
Synonyms: 8-(ethylamino)-6-hydroxy-7-[2-hydroxy-3-(4-methylphenoxy)propyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CCNc1nc2c(n1CC(COc1ccc(cc1)C)O)c(O)nc(=O)n2C

STK586795
Synonyms: 2-{[4-(4-chlorophenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,5-dimethoxyphenyl)acetamide
Smiles: COc1cc(NC(=O)CSc2nnc(n2c2ccc(cc2)Cl)Cc2cccs2)cc(c1)OC

STK586796
Synonyms: N'-[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]-4-methoxy-1H-indole-2-carbohydrazide
Smiles: COc1cccc(c1O)/C=N/NC(=O)c1cc2c([nH]1)cccc2OC

STK586797
Synonyms: N-(2,3-dimethylphenyl)-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-3-nitrobenzamide
Smiles: Cc1cccc(c1C)N(C(=O)c1cccc(c1)[N+](=O)[O-])Cc1cc2cccc(c2[nH]c1=O)C

STK586798
Synonyms: 3-(4-chlorobenzyl)-8-(4-methoxyphenyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1)Cl

STK586799
Synonyms: 2-[(4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]-N-(pyridin-2-ylmethyl)acetamide
Smiles: O=C(NCc1ccccn1)COc1ccc2c(c1C)oc(=O)cc2C

STK586800
Synonyms: N-[6-chloro-3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl]-2-phenylacetamide
Smiles: O=C(Nc1oc2ccc(cc2c(=O)c1c1ccc(cc1)F)Cl)Cc1ccccc1

STK586801
Synonyms: 2-{[4-(4-chlorophenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccccc1

STK586802
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-ethylphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2CC)nnc1COc1ccc(cc1)Cl

STK586803
Synonyms: 3-methyl-1'-(4-methylpentyl)-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CC(CCCN1C(=O)NC(=O)C2(C1=O)Cc1ccccc1N1C2CN(C)CC1)C

STK586804
Synonyms: N-(4-bromo-3-methylphenyl)-2-{[4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)C)Br)CSc1nnc(n1c1ccc(cc1)C)COc1ccccc1

STK586806
Synonyms: 1-(3-methoxyphenyl)-3-(phenylsulfonyl)-1H-pyrrolo[2,3-b]quinoxalin-2-amine
Smiles: COc1cccc(c1)n1c2nc3ccccc3nc2c(c1N)S(=O)(=O)c1ccccc1

STK586807
Synonyms: (5Z)-5-[(1-benzyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]-6-hydroxy-2-sulfanylpyrimidin-4(5H)-one
Smiles: SC1=NC(=O)/C(=C\c2ccc3c(c2)CCCN3Cc2ccccc2)/C(=N1)O

STK586808
Synonyms: 2-(1,3-benzoxazol-2-ylamino)-7,7-dimethyl-4-(4-methylphenyl)-4,6,7,8-tetrahydroquinazolin-5-ol
Smiles: Cc1ccc(cc1)C1N=C(Nc2nc3c(o2)cccc3)N=C2C1=C(O)CC(C2)(C)C

STK586809
Synonyms: 3-[4-(ethoxycarbonyl)phenoxy]-2-methyl-8-[(2-methylpiperidinium-1-yl)methyl]-4-oxo-4H-chromen-7-olate
Smiles: CCOC(=O)c1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2C[NH+]1CCCCC1C)[O-]

STK586810
Synonyms: 10-[4-(dimethylamino)phenyl]-5-(4-methoxyphenyl)-1,3,7,7-tetramethyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: COc1ccc(cc1)c1c2c(c3n1C(C)(C)COC3c1ccc(cc1)N(C)C)n(C)c(=O)n(c2=O)C

STK586812
Synonyms: N'-[(E)-(4-ethoxyphenyl)methylidene]-4,5,6-trimethoxy-1H-indole-2-carbohydrazide
Smiles: CCOc1ccc(cc1)/C=N/NC(=O)c1cc2c([nH]1)cc(c(c2OC)OC)OC

STK586813
Synonyms: N-benzyl-2-{[3-cyano-5-hydroxy-4-(4-hydroxy-3-methoxyphenyl)-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)NCc2ccccc2)N=C2C(=C(O)CCC2)C1c1ccc(c(c1)OC)O

STK586816
Synonyms: (4E)-2-(3,4-dimethylphenyl)-4-({[3-(morpholin-4-yl)propyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: O=C1N(c2ccc(c(c2)C)C)C(=O)c2c(/C/1=C\NCCCN1CCOCC1)cccc2

STK586817
Synonyms: 6,7-dimethoxy-2-[(2,4,6-trimethylphenyl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc2CN(CCc2cc1OC)S(=O)(=O)c1c(C)cc(cc1C)C

STK586819
Synonyms: (6E)-5-imino-2-(pyridin-4-yl)-6-(1H-pyrrol-2-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: O=C1N=c2sc(nn2C(=N)/C/1=C\c1ccc[nH]1)c1ccncc1

STK586822
Synonyms: 5-[3-(6-chloro-2-hydroxy-4-phenylquinolin-3-yl)-5-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoicacid
Smiles: OC(=O)CCCC(=O)N1N=C(CC1c1ccccc1F)c1c(O)nc2c(c1c1ccccc1)cc(cc2)Cl

STK586823
Synonyms: 5-(4-fluorophenyl)-4-{[(1E,2E)-3-(2-methoxyphenyl)prop-2-en-1-ylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccccc1/C=C/C=N/n1c(=S)[nH]nc1c1ccc(cc1)F

STK586824
Synonyms: N-[(2E)-5-[(E)-2-(4-chlorophenyl)ethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]-2-phenoxypropanamide
Smiles: Clc1ccc(cc1)/C=C/c1n[nH]/c(=N\C(=O)C(Oc2ccccc2)C)/s1

STK586825
Synonyms: [4-(difluoromethoxy)-3-ethoxyphenyl](7-methyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)methanone
Smiles: CCOc1cc(ccc1OC(F)F)C(=O)N1CCc2c(C1C)cc1c(c2)OCCCO1

STK586826
Synonyms: 6-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-(2-fluorophenyl)hexanamide
Smiles: O=C(Nc1ccccc1F)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK586827
Synonyms: (3S,3a'R,8a'S,8b'S)-5-chloro-7-methyl-2'-(4-methylphenyl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Cc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cc(Cl)cc2C

STK586828
Synonyms: 7-chloro-6-methyl-2-(5-methyl-1,2-oxazol-3-yl)-1-[4-(propan-2-yl)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1ccc(cc1)C(C)C)c(=O)c1c(o2)cc(c(c1)Cl)C

STK586829
Synonyms: (3a'R,8b'S)-5-chloro-2'-(2-methoxyethyl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(N3C2CCC3)C(=O)Nc2c1cc(Cl)cc2

STK586832
Synonyms: 2-{[3-cyano-4-(furan-2-yl)-5-hydroxy-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(2,4-dichlorophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2Cl)Cl)N=C2C(=C(O)CCC2)C1c1ccco1

STK586833
Synonyms: 2-{[3-cyano-4-(furan-2-yl)-5-hydroxy-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C2=C(CCCC2=N1)O)c1ccco1

STK586834
Synonyms: 2-(6-fluoro-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccccc1F)c(=O)c1c(o2)cccc1

STK586836
Synonyms: 3-cyclohexyl-N-(4-methoxybenzyl)-3-[4-(propan-2-yloxy)phenyl]propan-1-amine
Smiles: COc1ccc(cc1)CNCCC(c1ccc(cc1)OC(C)C)C1CCCCC1

STK586838
Synonyms: (2E)-3-(3-chlorophenyl)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)prop-2-en-1-one
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)/C=C/c1cccc(c1)Cl

STK586841
Synonyms: N-[(2Z)-3-(2-methoxybenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-phenylacetamide
Smiles: COc1ccccc1CN1/C(=N/C(=O)Cc2ccccc2)/SC2C1CS(=O)(=O)C2

STK586844
Synonyms: 2-{[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methylphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C)nnc1COc1ccccc1

STK586845
Synonyms: 4-{[({4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

STK586846
Synonyms: 3-(benzylsulfanyl)-8,8-dimethyl-5-(phenylamino)-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
Smiles: N#Cc1c2CC(C)(C)OCc2c2n(c1Nc1ccccc1)c(SCc1ccccc1)nn2

STK586847
Synonyms: 2-[(4Z)-3-oxo-4-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)butan-2-yl]-1H-isoindole-1,3(2H)-dione
Smiles: O=C(C(N1C(=O)c2c(C1=O)cccc2)C)/C=C/1\NCCc2c1cc1OCCCOc1c2

STK586848
Synonyms: 1-(3-chloro-4-methylphenyl)-2'-ethyl-6'-nitro-1'-propyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione
Smiles: CCCN1c2ccc(cc2CC2(C1CC)C(=O)NC(=O)N(C2=O)c1ccc(c(c1)Cl)C)[N+](=O)[O-]

STK586849
Synonyms: 7-benzyl-8-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccccc1N1CCN(CC1)Cc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C

STK586850
Synonyms: 2-[(2,4-difluorophenyl)sulfonyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc2CN(CCc2cc1OC)S(=O)(=O)c1ccc(cc1F)F

STK586851
Synonyms: (4E)-4-[(4-bromophenyl)(hydroxy)methylidene]-5-(4-methylphenyl)-1-(prop-2-en-1-yl)pyrrolidine-2,3-dione
Smiles: C=CCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)Br)/O)/C1c1ccc(cc1)C

STK586854
Synonyms: 1-{[4-amino-5-(5-phenyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}propan-2-one
Smiles: CC(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccccc1

STK586855
Synonyms: 2-({4-amino-5-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,5-dimethylphenyl)acetamide
Smiles: O=C(Nc1cc(C)cc(c1)C)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK586857
Synonyms: 2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-N-[4-(trifluoromethoxy)phenyl]acetamide
Smiles: O=C(Cn1c(O)nc2c(c1=O)cccc2)Nc1ccc(cc1)OC(F)(F)F

STK586858
Synonyms: N-[(2Z)-3-(2,4-difluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: Fc1ccc(c(c1)F)N1/C(=N/C(=O)C)/SC2C1CS(=O)(=O)C2

STK586859
Synonyms: 2-chloro-5-{5-[(Z)-(2-hydroxy-5-oxo-1-phenyl-1,5-dihydro-4H-imidazol-4-ylidene)methyl]furan-2-yl}benzoicacid
Smiles: OC1=N/C(=C\c2ccc(o2)c2ccc(c(c2)C(=O)O)Cl)/C(=O)N1c1ccccc1

STK586861
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,5-dimethoxyphenyl)acetamide
Smiles: COc1cc(NC(=O)CSc2nnc(n2c2ccc(cc2)C)c2cccc(c2)Cl)cc(c1)OC

STK586862
Synonyms: N~2~-{[1-(tert-butoxycarbonyl)-4-phenylpiperidin-4-yl]carbonyl}-D-asparagine
Smiles: O=C(C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1)N[C@@H](C(=O)O)CC(=O)N

STK586863
Synonyms: 2-ethyl-1-(3-fluorophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCN1C(=O)c2c(C1c1cccc(c1)F)c(=O)c1c(o2)cccc1

STK586864
Synonyms: 2-fluoro-N-[4-(3-methoxyphenyl)-6-methyl-2-(4-methylphenyl)-5-oxo-2,5-dihydropyridazin-3-yl]benzamide
Smiles: COc1cccc(c1)c1c(=O)c(C)nn(c1NC(=O)c1ccccc1F)c1ccc(cc1)C

STK586865
Synonyms: 7-chloro-1-(3,4-dichlorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1ccc(c(c1)Cl)Cl)c(=O)c1c(o2)ccc(c1)Cl

STK586866
Synonyms: tert-butyl[(1S)-1-{5-[(3-fluorobenzyl)sulfonyl]-1,3,4-oxadiazol-2-yl}ethyl]carbamate
Smiles: O=C(OC(C)(C)C)N[C@H](c1nnc(o1)S(=O)(=O)Cc1cccc(c1)F)C

STK586867
Synonyms: 7-fluoro-2-(2-hydroxyethyl)-1-(3-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: OCCN1C(=O)c2c(C1c1cccc(c1)[N+](=O)[O-])c(=O)c1c(o2)ccc(c1)F

STK586868
Synonyms: N-(1,3-benzodioxol-5-yl)-2-({5-[(4-methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CSc1nnc(n1c1ccccc1)COc1ccc(cc1)C

STK586872
Synonyms: 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-6-methyl-N-(1,3-thiazol-2-yl)heptanamide
Smiles: CC(CCC(C1CCOC(C1)(C)C)CC(=O)Nc1nccs1)C

STK586875
Synonyms: 2-{[2-(3-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-N-phenylacetamide
Smiles: COc1cccc(c1)c1nc(SCC(=O)Nc2ccccc2)c2c(n1)CC(OC2)(C)C

STK586877
Synonyms: 5,7-dichloro-2-(5-methyl-1,2-oxazol-3-yl)-1-(4-propoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCCOc1ccc(cc1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)c(Cl)cc(c1)Cl

STK586881
Synonyms: 3-[4-(phenylcarbonyl)piperazin-1-yl]-1-(propan-2-yl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile
Smiles: N#Cc1c(nc(c2c1CCC2)C(C)C)N1CCN(CC1)C(=O)c1ccccc1

STK586886
Synonyms: N-{(1Z)-1-[1-cyano-2-(morpholin-4-yl)-2-oxoethylidene]-1H-isoindol-3-yl}-2-methylbenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccccc1C)/C(=O)N1CCOCC1

STK586887
Synonyms: 2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-ethyl-6-methylphenyl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1c(C)cccc1CC

STK586888
Synonyms: 4-{[(E)-(2-ethoxyphenyl)methylidene]amino}-5-(3-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccccc1/C=N/n1c(=S)[nH]nc1c1cccc(c1)C

STK586890
Synonyms: N-(2-methylpropyl)-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]furan-2-carboxamide
Smiles: CC(CN(C(=O)c1ccco1)Cc1cc2ccccc2[nH]c1=O)C

STK586891
Synonyms: (4E)-1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-[3-(pentyloxy)phenyl]pyrrolidine-2,3-dione
Smiles: CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nnc(s1)SCc1ccccc1

STK586892
Synonyms: 3-(1,3-benzothiazol-2-yl)-8-[(4-methylpiperidinium-1-yl)methyl]-4-oxo-4H-chromen-7-olate
Smiles: CC1CC[NH+](CC1)Cc1c([O-])ccc2c1occ(c2=O)c1nc2c(s1)cccc2

STK586893
Synonyms: 2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-chlorophenyl)ethanone
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Cl)nnc1c1ccc(cc1)C(C)(C)C

STK586894
Synonyms: 4-{[(2E)-2-(acetylamino)-3-phenylprop-2-enoyl]amino}butanoicacid
Smiles: O=C(/C(=C\c1ccccc1)/NC(=O)C)NCCCC(=O)O

STK586895
Synonyms: N-[3-(naphthalen-1-yl)-4-oxo-4H-chromen-2-yl]benzamide
Smiles: O=C(c1ccccc1)Nc1oc2ccccc2c(=O)c1c1cccc2c1cccc2

STK586896
Synonyms: (5Z)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-1-(3-methoxyphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: COc1cccc(c1)N1C(=NC(=O)/C(=C/c2cc(n(c2C)c2ccc(cc2)C)C)/C1=O)S

STK586899
Synonyms: N-[(2Z)-3-(2,4-dimethoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]propanamide
Smiles: CCC(=O)/N=C/1\SC2C(N1c1ccc(cc1OC)OC)CS(=O)(=O)C2

STK586900
Synonyms: 6,8-dibromo-2,4-dihydroxy-N-(prop-2-en-1-yl)quinoline-3-carboxamide
Smiles: C=CCNC(=O)c1c(O)nc2c(c1O)cc(cc2Br)Br

STK586902
Synonyms: 2-(methylamino)-3-{(Z)-[4-oxo-3-(3-phenylpropyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CNc1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCCc1ccccc1

STK586903
Synonyms: N-[3-(1,3-benzodioxol-5-yl)-6-chloro-4-oxo-4H-chromen-2-yl]thiophene-2-carboxamide
Smiles: Clc1ccc2c(c1)c(=O)c(c(o2)NC(=O)c1cccs1)c1ccc2c(c1)OCO2

STK586904
Synonyms: N-[(1Z)-1-{1-cyano-2-[(3,5-dimethylphenyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]-3,4-dimethoxybenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(c(c1)OC)OC)/C(=O)Nc1cc(C)cc(c1)C

STK586905
Synonyms: 1-hydroxy-5-methyl-9-oxo-9H-xanthen-3-yl6-[(tert-butoxycarbonyl)amino]hexanoate
Smiles: O=C(Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1C)CCCCCNC(=O)OC(C)(C)C

STK586907
Synonyms: ethyl2-{[(Z)-(6-hydroxy-4-oxo-2-sulfanylpyrimidin-5(4H)-ylidene)methyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N/C=C\2/C(=NC(=NC2=O)S)O)sc2c1CCCCC2

STK586908
Synonyms: 2-{[2-(diethylamino)ethyl]amino}-3-(furan-2-ylmethyl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCN(CCNc1nc2sc3c(c2c(=O)n1Cc1ccco1)CCCCC3)CC

STK586909
Synonyms: N-[5-(acetylamino)-2-methoxyphenyl]-2-{[4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cc(ccc2OC)NC(=O)C)nnc1c1ccccc1

STK586910
Synonyms: 11-cyclohexyl-3-heptyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCCCCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2C1CCCCC1

STK586911
Synonyms: (3a'S,6a'R)-5-bromo-5'-butyl-3'-methyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C)C(=O)Nc2c1cc(Br)cc2

STK586916
Synonyms: (2Z)-2-[(2E)-3-(2-methoxyphenyl)prop-2-en-1-ylidene]-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: COc1ccccc1/C=C/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCOCC1)[O-]

STK586919
Synonyms: 6,7-dimethyl-2-(5-methyl-1,2-oxazol-3-yl)-1-[3-(prop-2-en-1-yloxy)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: C=CCOc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)C)C

STK586922
Synonyms: 5,7-dimethyl-4-[(2-methylpiperidin-1-yl)methyl]-2H-chromen-2-one
Smiles: Cc1cc(C)c2c(c1)oc(=O)cc2CN1CCCCC1C

STK586923
Synonyms: (4E)-1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-ethoxy-4-propoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccccc2Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK586924
Synonyms: 3-[6-(morpholin-4-yl)-6-oxohexyl]-1,2,3-benzotriazin-4(3H)-one
Smiles: O=C(N1CCOCC1)CCCCCn1nnc2c(c1=O)cccc2

STK586925
Synonyms: 5-(3,4,5-trimethoxyphenyl)-4-{[(E)-(2,3,4-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1c(OC)ccc(c1OC)/C=N/n1c(=S)[nH]nc1c1cc(OC)c(c(c1)OC)OC

STK586926
Synonyms: 2-{[5-(2-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(propan-2-yl)phenyl]acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(C)C)nnc1c1ccccc1Cl

STK586928
Synonyms: (4E)-5-(4-ethoxyphenyl)-1-(furan-2-ylmethyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2cccc(c2)[N+](=O)[O-])\O)/C(=O)C(=O)N1Cc1ccco1

STK586929
Synonyms: N-[(2Z)-3-(3,5-dichlorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methylpropanamide
Smiles: Clc1cc(Cl)cc(c1)N1/C(=N/C(=O)C(C)C)/SC2C1CS(=O)(=O)C2

STK586930
Synonyms: 2-[4-(2-fluorophenyl)piperazin-1-yl]-3-[(Z)-(4-oxo-3-propyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2F)/C1=O

STK586934
Synonyms: 4-[3-(2,4-dichlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-N,N-dimethylaniline
Smiles: Clc1ccc(c(c1)Cl)c1nnc2n1nc(s2)c1ccc(cc1)N(C)C

STK586935
Synonyms: (3R)-N-(2-methoxyethyl)-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: COCCNC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1

STK586937
Synonyms: ethyl2-amino-5'-methoxy-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[chromene-4,3'-indole]-3-carboxylate
Smiles: CCOC(=O)C1=C(N)OC2=C(C31C(=O)Nc1c3cc(OC)cc1)C(=O)CCC2

STK586938
Synonyms: 5-ethyl-7-(4-methylphenyl)benzimidazo[1',2':1,6]pyrimido[4,5-b]quinolin-14(5H)-one
Smiles: CCn1c2nc(c3ccc(cc3)C)n3c(c2c(=O)c2c1cccc2)nc1c3cccc1

STK586939
Synonyms: N-(5-chloro-2-methylphenyl)-2-{[5-(4-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCC(=O)Nc1cc(Cl)ccc1C

STK586940
Synonyms: ethyl6-({2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-4-(2-ethoxyphenyl)-2-hydroxy-3,4-dihydropyridine-3-carboxylate
Smiles: CCOC(=O)C1C(=NC(=C(C1c1ccccc1OCC)C#N)SCC(=O)Nc1ccc(c(c1)Cl)C)O

STK586942
Synonyms: 1-amino-4-(phenylamino)-2-(pyrrolidin-1-yl)anthracene-9,10-dione
Smiles: O=C1c2ccccc2C(=O)c2c1c(Nc1ccccc1)cc(c2N)N1CCCC1

STK586944
Synonyms: 2-({4-amino-5-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-methoxy-5-methylphenyl)acetamide
Smiles: COc1ccc(cc1NC(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C)C

STK586946
Synonyms: N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(2-methylpropyl)pyridine-3-carboxamide
Smiles: CC(CN(C(=O)c1cccnc1)Cc1cc2cc(C)ccc2[nH]c1=O)C

STK586947
Synonyms: N'-[(E)-(2-chloro-6-methoxyquinolin-3-yl)methylidene]pyridine-4-carbohydrazide
Smiles: COc1ccc2c(c1)cc(c(n2)Cl)/C=N/NC(=O)c1ccncc1

STK586948
Synonyms: N-(3-chlorophenyl)-4-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)methyl]cyclohexanecarboxamide
Smiles: Clc1cccc(c1)NC(=O)C1CCC(CC1)Cn1nnc2c(c1=O)cccc2

STK586949
Synonyms: (1'R,2'R)-1'-acetyl-2'-(2,5-dimethoxyphenyl)-7'-methyl-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(c(c1)[C@H]1[C@H](C(=O)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)C)OC

STK586950
Synonyms: [(1R,4aS,8aS)-1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](2-fluorophenyl)methanone
Smiles: COc1cc(OC)ccc1[C@@H]1N(CC[C@@]2([C@H]1CCCC2)O)C(=O)c1ccccc1F

STK586952
Synonyms: 2-[(3a'S,6a'R)-5'-cyclohexyl-5-fluoro-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]acetamide
Smiles: NC(=O)CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C1CCCCC1)C(=O)Nc1c2cc(F)cc1

STK586953
Synonyms: (2E)-N-[(2Z)-5-(ethylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-(furan-2-yl)prop-2-enamide
Smiles: CCS(=O)(=O)c1n[nH]/c(=N/C(=O)/C=C/c2ccco2)/s1

STK586954
Synonyms: 4-(9-hydroxy-7,7-dimethyl-11-oxo-7,8,10,11-tetrahydro-6H-indeno[1,2-b]quinolin-10-yl)phenylphenyl(phenylsulfanyl)acetate
Smiles: OC1=C2C(=NC3=C(C2c2ccc(cc2)OC(=O)C(c2ccccc2)Sc2ccccc2)C(=O)c2c3cccc2)CC(C1)(C)C

STK586955
Synonyms: N-[(4-ethoxyphenyl)carbamoyl]-L-leucine
Smiles: CCOc1ccc(cc1)NC(=O)N[C@H](C(=O)O)CC(C)C

STK586957
Synonyms: 2-({4-amino-5-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-sulfamoylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)N)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK586958
Synonyms: (4E)-2-(2,5-dimethoxyphenyl)-4-{[(3-methylbutyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: COc1ccc(c(c1)N1C(=O)/C(=C/NCCC(C)C)/c2c(C1=O)cccc2)OC

STK586959
Synonyms: 2-{5-[(3-fluorobenzyl)sulfanyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Cc1ccc(cc1)n1c(SCc2cccc(c2)F)nnc1c1ccccn1

STK586960
Synonyms: 4-{[(E)-(4-chloro-3-nitrophenyl)methylidene]amino}-5-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccc(c(c1)[N+](=O)[O-])Cl

STK586961
Synonyms: 1-(4-chlorophenyl)-2-(6-methoxy-1,3-benzothiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccc(cc1)Cl)c(=O)c1c(o2)cccc1

STK586964
Synonyms: 3-[(4-tert-butylbenzyl)sulfanyl]-5-(3-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazole
Smiles: Clc1ccc(cc1)n1c(SCc2ccc(cc2)C(C)(C)C)nnc1c1cccc(c1)Cl

STK586965
Synonyms: 4-hydroxy-8-(2-hydroxyphenyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purin-2(6H)-one
Smiles: Oc1ccccc1N1CCn2c1nc1c2c(O)nc(=O)n1C

STK586966
Synonyms: 3-(pyridin-3-ylmethyl)-3,4,7,8,9,10-hexahydro-2H,6H-benzo[3,4]chromeno[8,7-e][1,3]oxazin-6-one
Smiles: O=c1oc2c3CN(COc3ccc2c2c1CCCC2)Cc1cccnc1

STK586968
Synonyms: 4-{[({5-[(4-methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1c1ccccc1)COc1ccc(cc1)C

STK586969
Synonyms: 2-[4-(4-fluorophenyl)piperazin-1-yl]-N-[(2Z)-4-phenyl-1,3-thiazol-2(3H)-ylidene]acetamide
Smiles: Fc1ccc(cc1)N1CCN(CC1)CC(=O)/N=c/1\scc([nH]1)c1ccccc1

STK586970
Synonyms: (4E)-4-{[(1,1-dioxidotetrahydrothiophen-3-yl)amino]methylidene}-2-(2-fluorophenyl)isoquinoline-1,3(2H,4H)-dione
Smiles: O=C1/C(=C/NC2CCS(=O)(=O)C2)/c2ccccc2C(=O)N1c1ccccc1F

STK586971
Synonyms: N-(3,5-dimethoxyphenyl)-2-{[4-(prop-2-en-1-yl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cc(OC)cc(c2)OC)nnc1Cc1cccs1

STK586972
Synonyms: 1-methyl-8-(2-methylphenyl)-3-(2-phenylethyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: Cc1ccccc1N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCc1ccccc1

STK586973
Synonyms: N'-{(1E)-1-[4-hydroxy-1-(4-methoxyphenyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]propyl}pentanehydrazide
Smiles: CCCCC(=O)NN/C(=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)OC)O)/CC

STK586975
Synonyms: 6-(4-chlorophenyl)-9-(4-methylphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Cc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccc(cc1)Cl

STK586976
Synonyms: N,N-dibutyl-2-[(7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: CCCCN(C(=O)CSc1nc(nc2c1COC(C2)(C)C)c1ccccc1)CCCC

STK586978
Synonyms: 3-{(2S)-1-[4-(4-fluorophenyl)piperazin-1-yl]-1-oxopropan-2-yl}-1,2,3-benzotriazin-4(3H)-one
Smiles: Fc1ccc(cc1)N1CCN(CC1)C(=O)[C@@H](n1nnc2c(c1=O)cccc2)C

STK586979
Synonyms: 2-{[6,6-dimethyl-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-1-(4-nitrophenyl)ethanone
Smiles: CSc1nc(SCC(=O)c2ccc(cc2)[N+](=O)[O-])c2c(n1)sc1c2CC(OC1)(C)C

STK586980
Synonyms: 3-cyclohexyl-2-(4-methoxyphenyl)-10-methylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: COc1ccc(cc1)c1nc2c(c(=O)n1C1CCCCC1)c(=O)c1c(n2C)cccc1

STK586981
Synonyms: N,N-diethyl-N'-(5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinolin-8-yl)propane-1,3-diamine
Smiles: CCCc1nc2oc3c(c2c2c1CCCC2)ncnc3NCCCN(CC)CC

STK586984
Synonyms: 2-hydroxy-3-methyl-6-[(2E)-1-methyl-2-(pyridin-4-ylmethylidene)hydrazinyl]pyrimidin-4(3H)-one
Smiles: CN(c1nc(O)n(c(=O)c1)C)/N=C/c1ccncc1

STK586985
Synonyms: (4E)-2-(2,3-dimethylphenyl)-4-({[(1-ethylpyrrolidin-2-yl)methyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: CCN1CCCC1CN/C=C/1\c2ccccc2C(=O)N(C1=O)c1cccc(c1C)C

STK586986
Synonyms: 5-(2,3-dichlorophenyl)-2-(4-methoxyphenyl)-4-phenyl-1H-imidazole
Smiles: COc1ccc(cc1)c1[nH]c(c(n1)c1ccccc1)c1cccc(c1Cl)Cl

STK586988
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(6-oxo-3,4-dihydro-2H-[1,3]thiazino[3',2':1,2]pyrimido[5,4-b]indol-7(6H)-yl)acetamide
Smiles: COc1cc(CCNC(=O)Cn2c3ccccc3c3c2c(=O)n2CCCSc2n3)ccc1OC

STK586990
Synonyms: 8-(4-ethylpiperazin-1-yl)-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline
Smiles: CCN1CCN(CC1)c1ncnc2c1oc1c2c2CCCCc2c(n1)CC(C)C

STK586993
Synonyms: ethyl2-[1-(4-chlorophenyl)-3,9-dioxo-3,9-dihydrochromeno[2,3-c]pyrrol-2(1H)-yl]-1,3-benzothiazole-6-carboxylate
Smiles: CCOC(=O)c1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccc(cc1)Cl)c(=O)c1c(o2)cccc1

STK586994
Synonyms: ethyl4-[3-(2-amino-2-oxoethyl)-1,7-dimethyl-2,4-dioxo-1,2,3,4,7,8-hexahydropyrimido[2,1-f]purin-9(6H)-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)CC(=O)N

STK586996
Synonyms: 3-(2-methoxyethyl)-8-(3-methoxyphenyl)-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COCCn1c(=O)c2n3cc(n(c3nc2n(c1=O)C)c1cccc(c1)OC)C

STK586998
Synonyms: (2E)-3-(1,3-benzodioxol-5-yl)-1-[2-(4-methoxyphenyl)-6,7-dihydro[1,3]thiazolo[5,4-c]pyridin-5(4H)-yl]prop-2-en-1-one
Smiles: COc1ccc(cc1)c1nc2c(s1)CN(CC2)C(=O)/C=C/c1ccc2c(c1)OCO2

STK586999
Synonyms: 8-(3,5-dimethylphenyl)-4-hydroxy-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purin-2(6H)-one
Smiles: Cc1cc(C)cc(c1)N1CCn2c1nc1c2c(O)nc(=O)n1C

STK587000
Synonyms: 8-(dimethylamino)-6-hydroxy-7-[2-hydroxy-3-(4-methylphenoxy)propyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: OC(Cn1c(nc2c1c(O)nc(=O)n2C)N(C)C)COc1ccc(cc1)C

STK587002
Synonyms: (4E)-5-(4-bromophenyl)-4-[(4-bromophenyl)(hydroxy)methylidene]-1-methylpyrrolidine-2,3-dione
Smiles: Brc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)Br)N(C(=O)C1=O)C)/O

STK587003
Synonyms: (4Z)-2-(2,4-dimethylphenyl)-4-{[(4-hydroxyphenyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: Oc1ccc(cc1)N/C=C\1/c2ccccc2C(=O)N(C1=O)c1ccc(cc1C)C

STK587004
Synonyms: 4-({[trans-4-({[3-(5-methyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanoyl]amino}methyl)cyclohexyl]carbonyl}amino)butanoicacid
Smiles: O=C(CCc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccccc1)NC[C@@H]1CC[C@H](CC1)C(=O)NCCCC(=O)O

STK587005
Synonyms: N-(4-bromophenyl)-2-{[4-(4-chlorophenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nnc(n1c1ccc(cc1)Cl)Cc1cccs1

STK587007
Synonyms: 4-{[(E)-(5-methylfuran-2-yl)methylidene]amino}-5-(3-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(o1)C

STK587008
Synonyms: 2-amino-1-[3-(dimethylamino)propyl]-N-(2-methoxyethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCCN(C)C

STK587009
Synonyms: 4-{(2E)-2-[(2-hydroxy-7-methoxyquinolin-3-yl)methylidene]hydrazinyl}benzoicacid
Smiles: COc1ccc2c(c1)nc(c(c2)/C=N/Nc1ccc(cc1)C(=O)O)O

STK587010
Synonyms: 6'-chloro-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: O=C1N(C)C(=O)C2(C(=O)N1C)Cc1c(Cl)cccc1N1C2CCC1

STK587011
Synonyms: 6,8-dibromo-2,4-dihydroxy-N-(3-hydroxypropyl)quinoline-3-carboxamide
Smiles: OCCCNC(=O)c1c(O)nc2c(c1O)cc(cc2Br)Br

STK587014
Synonyms: 2-[4-(6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)-4-oxobutyl]-1H-isoindole-1,3(2H)-dione
Smiles: COc1cc2c(cc1OC)CCN(C2C)C(=O)CCCN1C(=O)c2c(C1=O)cccc2

STK587016
Synonyms: N-{[1-(tert-butoxycarbonyl)-4-phenylpiperidin-4-yl]carbonyl}-D-methionine
Smiles: CSCC[C@H](C(=O)O)NC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1

STK587017
Synonyms: (1'R,2'R)-2'-(3-chlorophenyl)-1'-[(2-chlorophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1cccc(c1)[C@H]1[C@H](C(=O)c2ccccc2Cl)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1

STK587018
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-methoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)OC)nnc1COc1ccc(cc1)Cl

STK587019
Synonyms: 4-(4-benzylpiperidin-1-yl)-1-methyl-3-nitroquinolin-2(1H)-one
Smiles: Cn1c(=O)c([N+](=O)[O-])c(c2c1cccc2)N1CCC(CC1)Cc1ccccc1

STK587020
Synonyms: 5-(2-methylpropyl)-8-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline
Smiles: CC(Cc1nc2oc3c(c2c2c1CCCC2)ncnc3N1CCOCC1)C

STK587021
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(2,4-dimethoxyphenyl)carbonyl]-2'-[(4-methylphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccc(c(c1)OC)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)C)C(=O)Nc1c2cccc1)cccc3

STK587022
Synonyms: N-(2-ethyl-6-methylphenyl)-2-({4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: CCc1cccc(c1NC(=O)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C)C

STK587023
Synonyms: 2-{[4-amino-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-sulfamoylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)N)CSc1nnc(n1N)c1[nH]nc2c1CCC2

STK587024
Synonyms: trans-4-{[({[(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)amino]methyl}cyclohexanecarboxylicacid
Smiles: O=C(COc1ccc2c(c1)O/C(=C\c1ccc3c(c1)OCO3)/C2=O)NC[C@@H]1CC[C@H](CC1)C(=O)O

STK587026
Synonyms: methyl{8-[(4-benzylpiperidin-1-yl)methyl]-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate
Smiles: COC(=O)Cn1c(CN2CCC(CC2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK587028
Synonyms: 6-chloro-7-hydroxy-4-phenyl-8-{[(pyridin-4-ylmethyl)amino]methyl}-2H-chromen-2-one
Smiles: O=c1cc(c2ccccc2)c2c(o1)c(CNCc1ccncc1)c(c(c2)Cl)O

STK587029
Synonyms: 4-(2-chlorophenyl)-5-hydroxy-2-(methylsulfanyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: CSC1=C(C#N)C(C2=C(CCCC2=N1)O)c1ccccc1Cl

STK587030
Synonyms: N-[(2Z)-4-(4-methoxyphenyl)-1,3-thiazol-2(3H)-ylidene]-4-(2-oxo-2H-chromen-3-yl)benzamide
Smiles: COc1ccc(cc1)c1cs/c(=N\C(=O)c2ccc(cc2)c2cc3ccccc3oc2=O)/[nH]1

STK587032
Synonyms: N-[(2Z)-3-benzyl-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-(2-chlorophenyl)acetamide
Smiles: O=C(Cc1ccccc1Cl)/N=C/1\SC2C(N1Cc1ccccc1)CS(=O)(=O)C2

STK587033
Synonyms: 2-{[5-(3-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK587034
Synonyms: 3-(4-chlorobenzyl)-9-(4-chlorophenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Clc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccc(cc1)Cl

STK587036
Synonyms: 7-fluoro-1-(4-methoxyphenyl)-2-(6-methylpyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc(cc1)C1N(c2cccc(n2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK587037
Synonyms: 7-methoxy-3-(2-sulfanylethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: SCCn1cnc2c(c1=O)[nH]c1c2ccc(c1)OC

STK587039
Synonyms: 4-[(E)-{(2E)-[4-(2,4-dichlorophenyl)-1,3-thiazol-2(3H)-ylidene]hydrazinylidene}methyl]phenol
Smiles: Oc1ccc(cc1)/C=N/N=c\1/scc([nH]1)c1ccc(cc1Cl)Cl

STK587040
Synonyms: 4-{[(E)-(2-fluorophenyl)methylidene]amino}-5-(2-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccccc1F

STK587042
Synonyms: methyl4-[7-chloro-6-methyl-3,9-dioxo-2-(pyridin-2-yl)-1,2,3,9-tetrahydrochromeno[2,3-c]pyrrol-1-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(c2ccccn2)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK587043
Synonyms: 3-[(2,4-dichlorobenzyl)oxy]-1-hydroxy-5-methyl-9H-xanthen-9-one
Smiles: Clc1ccc(c(c1)Cl)COc1cc(O)c2c(c1)oc1c(c2=O)cccc1C

STK587044
Synonyms: 6-{[3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanoyl]amino}hexanoicacid
Smiles: O=C(CCn1nnc2c(c1=O)cccc2)NCCCCCC(=O)O

STK587045
Synonyms: 8-(2-methoxyphenyl)-1-methyl-3-(3-methylbutyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COc1ccccc1N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCC(C)C

STK587046
Synonyms: 1-benzyl-6-cyclopentyl-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: O=c1nc(S)n(c2c1CN(CN2)C1CCCC1)Cc1ccccc1

STK587048
Synonyms: N-(4-bromophenyl)-2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)Br)nnc1COc1ccc(cc1)Cl

STK587050
Synonyms: 4-[2-chloro-5-(trifluoromethyl)phenyl]-5-(pyridin-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: S=c1[nH]nc(n1c1cc(ccc1Cl)C(F)(F)F)c1cccnc1

STK587051
Synonyms: 6-butyl-2-methyl-4-(4-methylphenyl)pyridazino[3',4':4,5]pyrimido[1,6-a]benzimidazol-1(4H)-one
Smiles: CCCCc1nc2n(nc(c(=O)c2c2n1c1ccccc1n2)C)c1ccc(cc1)C

STK587052
Synonyms: (4Z)-2-(3-bromophenyl)-4-(3,4-diethoxybenzylidene)-1,3-oxazol-5(4H)-one
Smiles: CCOc1cc(ccc1OCC)/C=C/1\N=C(OC1=O)c1cccc(c1)Br

STK587053
Synonyms: [2-chloro-5-(methylsulfanyl)phenyl](6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: CSc1ccc(c(c1)C(=O)N1CCc2c(C1)cc(c(c2)OC)OC)Cl

STK587055
Synonyms: 3-(2-bromophenoxy)-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-4-oxo-4H-chromen-7-olate
Smiles: CN1CC[NH+](CC1)Cc1c([O-])ccc2c1occ(c2=O)Oc1ccccc1Br

STK587057
Synonyms: N-[(2Z)-3-(3-chloro-4-fluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]cyclopropanecarboxamide
Smiles: O=C(C1CC1)/N=C/1\SC2C(N1c1ccc(c(c1)Cl)F)CS(=O)(=O)C2

STK587058
Synonyms: N-(2-tert-butylphenyl)-2-{[5-(3-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2C(C)(C)C)nnc1c1cccc(c1)OC

STK587060
Synonyms: 5-(2-bromophenyl)-4-{[(E)-(2-chloro-5-nitrophenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1ccc(cc1/C=N/n1c(=S)[nH]nc1c1ccccc1Br)[N+](=O)[O-]

STK587061
Synonyms: 8-(4-ethylpiperazin-1-yl)-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN1CCN(CC1)c1nc2c(n1CC(COc1cccc(c1)C)O)c(=O)n(c(=O)n2C)C

STK587064
Synonyms: 6-cyclopentyl-1-(4-methylphenyl)-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Cc1ccc(cc1)n1c(S)nc(=O)c2c1NCN(C2)C1CCCC1

STK587066
Synonyms: 9-(3-methoxyphenyl)-1-methyl-3-[2-(morpholin-4-yl)ethyl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COc1cccc(c1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCOCC1

STK587067
Synonyms: 5-cyclopropyl-N'-[(1E)-1-(2-hydroxyphenyl)ethylidene]-1H-pyrazole-3-carbohydrazide
Smiles: O=C(c1n[nH]c(c1)C1CC1)N/N=C(/c1ccccc1O)\C

STK587071
Synonyms: 8-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-7-(2-methoxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCn1c(CN2CCN(CC2)c2cccc(c2)Cl)nc2c1c(=O)n(c(=O)n2C)C

STK587072
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-fluorophenyl)acetamide
Smiles: O=C(Nc1ccccc1F)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl

STK587073
Synonyms: N-[4-(dimethylamino)phenyl]-4-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)methyl]cyclohexanecarboxamide
Smiles: O=C(C1CCC(CC1)Cn1nnc2c(c1=O)cccc2)Nc1ccc(cc1)N(C)C

STK587074
Synonyms: N-(2,6-dimethylphenyl)-2-{[4-(4-methoxyphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cccc2C)nnc1Cc1cccs1

STK587075
Synonyms: 5-(2-chlorophenyl)-4-{[(E)-(2,5-dimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(c(c1)/C=N/n1c(=S)[nH]nc1c1ccccc1Cl)OC

STK587076
Synonyms: 2-{[6,6-dimethyl-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Smiles: CSc1nc(SCC(=O)Nc2cccc(c2)C)c2c(n1)sc1c2CC(OC1)(C)C

STK587077
Synonyms: 2-[5-(3,4-dichlorophenyl)furan-2-yl]-4-imino-9,10-dimethoxy-6,7-dihydro-4H-pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: COc1cc2CCn3c(c2cc1OC)cc(c(c3=N)C#N)c1ccc(o1)c1ccc(c(c1)Cl)Cl

STK587079
Synonyms: 2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(propan-2-yl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(C)C)CSc1nnc(n1c1ccccc1)c1cnccn1

STK587080
Synonyms: (E)-1-(2-chlorophenyl)-N-{[11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methoxy}methanimine
Smiles: Clc1ccccc1/C=N/OCc1nn2c(n1)c1c(nc2)Oc2c(C1c1ccco1)c(C)nn2c1ccccc1

STK587085
Synonyms: 2-({3-cyano-5-hydroxy-4-[4-(propan-2-yl)phenyl]-4,6,7,8-tetrahydroquinolin-2-yl}sulfanyl)acetamide
Smiles: N#CC1=C(SCC(=O)N)N=C2C(=C(O)CCC2)C1c1ccc(cc1)C(C)C

STK587086
Synonyms: 2-fluoro-N-{1-methyl-4-oxo-3-[3-(trifluoromethyl)phenyl]-1,4-dihydroquinolin-2-yl}benzamide
Smiles: O=C(c1ccccc1F)Nc1n(C)c2ccccc2c(=O)c1c1cccc(c1)C(F)(F)F

STK587088
Synonyms: methyl3-({[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]carbonyl}amino)-1H-1,2,4-triazole-5-carboxylate
Smiles: COC(=O)c1[nH]nc(n1)NC(=O)c1cn(nc1c1cccs1)c1ccccc1

STK587090
Synonyms: 2'-hydroxy-1'-methyl-15,16-dihydro-4'H,4bH,6H,7H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1-a]isoquinoline-5,5'-pyrimidine]-4',6',7(1'H)-trione
Smiles: OC1=NC(=O)C2(C(=O)N1C)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2

STK587091
Synonyms: 8-benzyl-1,6,7-trimethyl-3-[2-(piperidin-1-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cn1c(=O)n(CCN2CCCCC2)c(=O)c2c1nc1n2c(c(n1Cc1ccccc1)C)C

STK587093
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(2-chlorophenyl)carbonyl]-3'-[(4-chlorophenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccc1Cl)C(=O)Nc1c2cccc1)cccc3

STK587095
Synonyms: 5-(2-chlorophenyl)-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(cc1)N(C)C

STK587096
Synonyms: 1-(4-fluorophenyl)-4-(4-nitrophenyl)-4,7-dihydrofuro[3,4-b]pyridine-2,5(1H,3H)-dione
Smiles: Fc1ccc(cc1)N1C(=O)CC(C2=C1COC2=O)c1ccc(cc1)[N+](=O)[O-]

STK587097
Synonyms: (3a'S,6a'R)-3'-(3,4-dihydroxybenzyl)-5'-(2-methoxyethyl)-5,7-dimethyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(c(c2)O)O)C(=O)Nc2c1cc(C)cc2C

STK587101
Synonyms: 6-chloro-4-propyl-9-(3,4,5-trimethoxybenzyl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: CCCc1cc(=O)oc2c1cc(Cl)c1c2CN(CO1)Cc1cc(OC)c(c(c1)OC)OC

STK587102
Synonyms: (1'R,2'S)-2'-(2-chlorophenyl)-1'-[(4-chlorophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccccc1Cl)C(=O)c1c(C2=O)cccc1

STK587103
Synonyms: N-(2-tert-butylphenyl)-2-{[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1C(C)(C)C)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)C

STK587104
Synonyms: 2-{[3-cyano-6-(3,4-dimethoxyphenyl)pyridin-2-yl]sulfanyl}-N-[(2E)-5-(ethylsulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]acetamide
Smiles: CCSc1n[nH]/c(=N\C(=O)CSc2nc(ccc2C#N)c2ccc(c(c2)OC)OC)/s1

STK587105
Synonyms: 2-({4-amino-5-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[4-(benzyloxy)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)OCc1ccccc1)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK587108
Synonyms: (4E)-2-(4-chlorophenyl)-4-[(methylamino)methylidene]isoquinoline-1,3(2H,4H)-dione
Smiles: CN/C=C\1/C(=O)N(c2ccc(cc2)Cl)C(=O)c2c1cccc2

STK587111
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(5-chloro-2-methylphenyl)-5-ethyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: CCc1ccc2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(Cl)ccc1C

STK587112
Synonyms: 6-(2-hydroxyphenyl)-9-(2-methylphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Oc1ccccc1C1CC(=C2C(=Nc3n(C2c2ccccc2C)ncn3)C1)O

STK587118
Synonyms: ethyl2-[1-(3-ethoxyphenyl)-3,9-dioxo-3,9-dihydrochromeno[2,3-c]pyrrol-2(1H)-yl]-1,3-benzothiazole-6-carboxylate
Smiles: CCOc1cccc(c1)C1N(c2nc3c(s2)cc(cc3)C(=O)OCC)C(=O)c2c1c(=O)c1c(o2)cccc1

STK587120
Synonyms: 11-methyl-3-(3-methylphenyl)-3,4-dihydro-2H-dibenzo[b,e][1,4]diazepin-1-ol
Smiles: Cc1cccc(c1)C1CC(=C2C(=Nc3ccccc3N=C2C)C1)O

STK587121
Synonyms: (4E)-2-(3-chlorophenyl)-4-({[(1-ethylpyrrolidin-2-yl)methyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: CCN1CCCC1CN/C=C/1\c2ccccc2C(=O)N(C1=O)c1cccc(c1)Cl