FULL DB

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

STK589271
Synonyms: 5-[7-(4-methoxyphenyl)-2-(methylsulfanyl)-6,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5(4H)-ylidene]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CSc1nn2c(n1)NC(=C1C(=O)N(C)C(=O)N(C1=O)C)CC2c1ccc(cc1)OC

STK851090
Synonyms: N-[4-(3,4-dimethoxyphenyl)-1,2,5-oxadiazol-3-yl]-2-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)CC(=O)Nc1nonc1c1ccc(c(c1)OC)OC

STK589274
Synonyms: 4-(2-methylpropyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-7-ol
Smiles: CC(Cc1nc2oc3c(c2c2c1CCC2)ncnc3O)C

STK851091
Synonyms: {[3-(2-ethoxyphenoxy)-2-methyl-4-oxo-4H-chromen-7-yl]oxy}acetonitrile
Smiles: CCOc1ccccc1Oc1c(C)oc2c(c1=O)ccc(c2)OCC#N

STK589278
Synonyms: 2-({4-amino-5-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-chloro-2-methylphenyl)acetamide
Smiles: O=C(Nc1cccc(c1C)Cl)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK589283
Synonyms: (6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)(4-phenoxyphenyl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1ccc(cc1)Oc1ccccc1

STK589286
Synonyms: (2Z)-3-[(5-fluoro-2-methylphenyl)amino]-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/Nc1cc(F)ccc1C)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK589287
Synonyms: 5-[(4-chlorobenzyl)amino]-2-(morpholin-4-ium-4-yl)benzoate
Smiles: Clc1ccc(cc1)CNc1ccc(c(c1)C(=O)[O-])[NH+]1CCOCC1

STK589288
Synonyms: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl](5-chloro-1H-indol-2-yl)methanone
Smiles: Clc1ccc2c(c1)cc([nH]2)C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK589293
Synonyms: N-cyclohexyl-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: O=c1[nH]c2ccccc2cc1CN(S(=O)(=O)c1ccccc1)C1CCCCC1

STK589299
Synonyms: 6,7-dimethyl-1-(3,4,5-trimethoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cc(cc(c1OC)OC)C1NC(=O)c2c1c(=O)c1c(o2)cc(c(c1)C)C

STK589301
Synonyms: 8-(2-ethylphenyl)-4-hydroxy-1,6,7-trimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: CCc1ccccc1n1c2nc3c(n2c(c1C)C)c(O)nc(=O)n3C

STK589303
Synonyms: 2-(furan-2-yl)-12-phenyl-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Smiles: O=C1CCCC2=C1C(c1ccccc1)c1c(O2)ncn2c1nc(n2)c1ccco1

STK851095
Synonyms: 1-benzyl-7-methyl-4-oxo-N-(tetrahydrofuran-2-ylmethyl)-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: Cc1ccc2n(c1)c(=O)c1c(n2)n(c(c1)C(=O)NCC1CCCO1)Cc1ccccc1

STK589307
Synonyms: 4-(2-fluorophenyl)-3-(2-hydroxy-3,5-dimethylphenyl)-5-(2-hydroxyethyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: OCCN1C(=O)c2c(C1c1ccccc1F)c([nH]n2)c1cc(C)cc(c1O)C

STK589309
Synonyms: methyl5-fluoro-3-{[(4-fluoro-3-methylphenyl)sulfonyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NS(=O)(=O)c1ccc(c(c1)C)F)cc(cc2)F

STK589310
Synonyms: 8-(3,5-dimethyl-1H-pyrazol-1-yl)-6-hydroxy-7-[2-(4-methoxyphenyl)ethyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: COc1ccc(cc1)CCn1c(nc2c1c(O)nc(=O)n2C)n1nc(cc1C)C

STK589315
Synonyms: N-[3-(butanoylamino)phenyl]-3,4-dimethylbenzamide
Smiles: CCCC(=O)Nc1cccc(c1)NC(=O)c1ccc(c(c1)C)C

STK851098
Synonyms: 1-benzyl-N,N,9-trimethyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: CN(C(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1C)C

STK851099
Synonyms: 7-methyl-4-oxo-N-(4-sulfamoylphenyl)-4H-chromene-2-carboxamide
Smiles: Cc1ccc2c(c1)oc(cc2=O)C(=O)Nc1ccc(cc1)S(=O)(=O)N

STK851100
Synonyms: 3-(2-methoxyethyl)-1,6,7-trimethyl-8-(2-phenylethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COCCn1c(=O)n(C)c2c(c1=O)n1c(n2)n(c(c1C)C)CCc1ccccc1

STK589323
Synonyms: 2-[4-(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)piperazin-1-yl]ethanol
Smiles: OCCN1CCN(CC1)c1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C

STK851102
Synonyms: 7-(3,5-dimethyl-1H-pyrazol-1-yl)-3,5-diphenylpyrazolo[1,5-a]pyrimidine
Smiles: Cc1nn(c(c1)C)c1cc(nc2n1ncc2c1ccccc1)c1ccccc1

STK851103
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(furan-2-ylmethyl)-6,8-dimethyl-4-oxo-4H-chromene-2-carboxamide
Smiles: Cc1cc(C)c2c(c1)c(=O)cc(o2)C(=O)N(C1CCS(=O)(=O)C1)Cc1ccco1

STK589331
Synonyms: N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetamide
Smiles: O=C(Cn1nnc2c(c1=O)cccc2)/N=c\1/sc2c([nH]1)cccc2

STK589332
Synonyms: 9,10-dimethoxy-2-[2-(morpholin-4-yl)ethoxy]-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one
Smiles: COc1cc2c(cc1OC)CCn1c2cc(OCCN2CCOCC2)nc1=O

STK589333
Synonyms: ethyl({6-cyano-8,8-dimethyl-5-[(4-methylphenyl)amino]-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetate
Smiles: CCOC(=O)CSc1nnc2n1c(Nc1ccc(cc1)C)c(C#N)c1c2COC(C1)(C)C

STK851107
Synonyms: 3-(4-chlorophenyl)-5-methyl-N-[2-(morpholin-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: Cc1cc(NCCN2CCOCC2)n2c(n1)c(cn2)c1ccc(cc1)Cl

STK589334
Synonyms: methylN-[(3-acetylphenyl)carbamoyl]-L-leucinate
Smiles: COC(=O)[C@@H](NC(=O)Nc1cccc(c1)C(=O)C)CC(C)C

STK589335
Synonyms: 8-[(2-chlorobenzyl)amino]-6-hydroxy-3-methyl-7-(2-methylprop-2-en-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: CC(=C)Cn1c(NCc2ccccc2Cl)nc2c1c(O)nc(=O)n2C

STK851109
Synonyms: N-(4-{[3-(2,3-dihydro-1,4-benzodioxin-2-yl)propanoyl]amino}-2-methylphenyl)benzamide
Smiles: O=C(Nc1ccc(c(c1)C)NC(=O)c1ccccc1)CCC1COc2c(O1)cccc2

STK589339
Synonyms: 2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]acetamide
Smiles: OCC(NC(=O)CN1C(=O)S/C(=C\c2ccccc2)/C1=O)Cc1ccccc1

STK589340
Synonyms: 5-(2-chlorobenzyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine
Smiles: Clc1ccccc1CN1CCc2c(C1)ccs2

STK851111
Synonyms: N-(5-chloropyridin-2-yl)quinoxaline-6-carboxamide
Smiles: Clc1ccc(nc1)NC(=O)c1ccc2c(c1)nccn2

STK589344
Synonyms: 7-(4-fluorophenyl)-3-(2-phenylethyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Fc1ccc(cc1)n1ncc2c1ncn1c2nnc1CCc1ccccc1

STK589350
Synonyms: methyl2-[(3aR,6aS)-3-(2,4-dichlorophenyl)-4,6-dioxo-3a,4,6,6a-tetrahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate
Smiles: COC(=O)c1ccccc1N1C(=O)[C@@H]2[C@H](C1=O)C(=NO2)c1ccc(cc1Cl)Cl

STK589355
Synonyms: (5s,7s)-2-[4-(benzyloxy)phenyl]-5-ethyl-7-methyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: CC[C@]12CN3C[C@@](C2=O)(CN(C1)C3c1ccc(cc1)OCc1ccccc1)C

STK589356
Synonyms: N-({1-[(4-methylphenyl)sulfonyl]piperidin-4-yl}carbonyl)-L-leucine
Smiles: CC(C[C@@H](C(=O)O)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C)C

STK589357
Synonyms: 4-chloro-N-(7-methoxy-2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-1-yl)benzamide
Smiles: COc1ccc2c(c1)nc1c(c2)CCN1NC(=O)c1ccc(cc1)Cl

STK851115
Synonyms: 3-phenyl-5-propyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: CCCc1cc(NCc2cccnc2)n2c(n1)c(cn2)c1ccccc1

STK851116
Synonyms: 6,8-dimethyl-N-{4-[(4-methylpiperidin-1-yl)sulfonyl]phenyl}-4-oxo-4H-chromene-2-carboxamide
Smiles: CC1CCN(CC1)S(=O)(=O)c1ccc(cc1)NC(=O)c1cc(=O)c2c(o1)c(C)cc(c2)C

STK589362
Synonyms: 2-oxo-7-phenyl-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2H-chromen-6-olate
Smiles: O=c1oc2cc(c3ccccc3)c(cc2c(c1)C[NH+]1CCN(CC1)c1ccccc1)[O-]

STK589365
Synonyms: N-[(4-benzylpiperidin-1-yl)carbonyl]-L-valine
Smiles: CC([C@@H](C(=O)O)NC(=O)N1CCC(CC1)Cc1ccccc1)C

STK851120
Synonyms: methyl(2Z)-3-(morpholin-4-yl)-2-(2-nitrophenyl)prop-2-enoate
Smiles: COC(=O)/C(=C\N1CCOCC1)/c1ccccc1[N+](=O)[O-]

STK589373
Synonyms: 1-ethyl-N-(4-fluorophenyl)-5-methoxy-2-methyl-1H-indole-3-carboxamide
Smiles: COc1ccc2c(c1)c(C(=O)Nc1ccc(cc1)F)c(n2CC)C

STK589376
Synonyms: N-[(2Z)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-3,3-dimethylbutanamide
Smiles: O=C(CC(C)(C)C)/N=C/1\SC2C(N1c1ccc3c(c1)OCCO3)CS(=O)(=O)C2

STK589381
Synonyms: 2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-4-(4-methylbenzyl)-1,2-dihydro-3H-pyrazol-3-one
Smiles: Cc1ccc(cc1)Cc1c(C)[nH]n(c1=O)c1nc(C)cc(n1)C

STK589382
Synonyms: 2-[8-imino-7-(4-methoxyphenyl)-7H-benzo[7,8]chromeno[2,3-d]pyrimidin-9(8H)-yl]-N,N-dimethylethanamine
Smiles: COc1ccc(cc1)C1c2c(ncn(c2=N)CCN(C)C)Oc2c1ccc1c2cccc1

STK589386
Synonyms: 1-{N-[(5-methoxy-1-methyl-1H-indol-2-yl)carbonyl]-L-methionyl}piperidine-4-carboxylicacid
Smiles: CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)O)NC(=O)c1cc2c(n1C)ccc(c2)OC

STK589389
Synonyms: 2-[(4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy]-N-(pyridin-2-ylmethyl)acetamide
Smiles: O=C(COc1ccc2c(c1C)oc(=O)c1c2cccc1)NCc1ccccn1

STK589392
Synonyms: {2-[(3aR,4R,4aR,7aS,8R,8aR)-5,7-dioxo-4,4a,5,6,7,7a,8,8a-octahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindol-3-yl]phenoxy}acetonitrile
Smiles: N#CCOc1ccccc1C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)NC2=O

STK851123
Synonyms: N-{4-[ethyl(phenyl)sulfamoyl]phenyl}-6-methyl-4-oxo-4H-chromene-2-carboxamide
Smiles: CCN(S(=O)(=O)c1ccc(cc1)NC(=O)c1cc(=O)c2c(o1)ccc(c2)C)c1ccccc1

STK589400
Synonyms: 4-ethyl-6-[(1E)-N-hydroxy-2-(1-methyl-1H-benzimidazol-2-yl)ethanimidoyl]benzene-1,3-diol
Smiles: O/N=C(/c1cc(CC)c(cc1O)O)\Cc1nc2c(n1C)cccc2

STK589406
Synonyms: (5Z)-5-(furan-2-ylmethylidene)-3-{3-[2-(2-hydroxyethyl)piperidin-1-yl]-3-oxopropyl}-2-thioxo-1,3-thiazolidin-4-one
Smiles: OCCC1CCCCN1C(=O)CCN1C(=S)S/C(=C\c2ccco2)/C1=O

STK589408
Synonyms: 5-(2-hydroxy-3,4-dimethylphenyl)-N-{4-[(2-methylpiperidin-1-yl)sulfonyl]phenyl}-1H-pyrazole-3-carboxamide
Smiles: CC1CCCCN1S(=O)(=O)c1ccc(cc1)NC(=O)c1n[nH]c(c1)c1ccc(c(c1O)C)C

STK589409
Synonyms: (4Z)-4-{2-[3-(1H-imidazol-1-ylmethyl)-4-methoxyphenyl]-4H-chromen-4-ylidene}-2-phenyl-1,3-oxazol-5(4H)-one
Smiles: COc1ccc(cc1Cn1ccnc1)C1=C/C(=C\2/N=C(OC2=O)c2ccccc2)/c2c(O1)cccc2

STK589410
Synonyms: 2,6-dihydroxy-3-(2-methoxyethyl)-5-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)pyrimidin-4(3H)-one
Smiles: COCCn1c(O)nc(c(c1=O)C1OC(=O)c2c1cccc2)O

STK589413
Synonyms: (3a'S,6a'R)-5'-(butan-2-yl)-3'-(3,4-dihydroxybenzyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CCC(N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(c(c2)O)O)C(=O)Nc2c1cccc2)C

STK589416
Synonyms: (4E)-1-(2-hydroxyethyl)-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione
Smiles: OCCN1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccc(c(c1)OC)O

STK589423
Synonyms: (4E)-2-(2,4-dichlorophenyl)-4-(4-methoxybenzylidene)-4H-imidazol-5-ol
Smiles: COc1ccc(cc1)/C=C\1/N=C(N=C1O)c1ccc(cc1Cl)Cl

STK589425
Synonyms: 3-(5-chloro-2-hydroxy-4-methylphenyl)-4-(3-hydroxyphenyl)-5-propyl-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: CCCN1C(=O)c2c(C1c1cccc(c1)O)c([nH]n2)c1cc(Cl)c(cc1O)C

STK589428
Synonyms: 2-(4-benzylpiperazin-1-yl)-6-methyl-5-(naphthalen-1-ylmethyl)pyrimidin-4-ol
Smiles: Cc1nc(nc(c1Cc1cccc2c1cccc2)O)N1CCN(CC1)Cc1ccccc1

STK589431
Synonyms: N-{[3-(4-fluorophenyl)-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]acetyl}-L-methionyl-beta-alanine
Smiles: CSCC[C@@H](C(=O)NCCC(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)F

STK589435
Synonyms: N-tert-butyl-2-{[3-cyano-5-hydroxy-4-(4-methoxyphenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)NC(C)(C)C)N=C2C(=C(O)CC(C2)(C)C)C1c1ccc(cc1)OC

STK589436
Synonyms: N-(5-hydroxy[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)butanamide
Smiles: CCCC(=O)Nc1cc(O)nc2n1ncn2

STK589437
Synonyms: (5Z)-5-[1-acetyl-5-(4-ethoxyphenyl)pyrazolidin-3-ylidene]-3-(4-chlorophenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCOc1ccc(cc1)C1C/C(=C/2\C(=NC(=O)N(C2=O)c2ccc(cc2)Cl)O)/NN1C(=O)C

STK589441
Synonyms: 3-(3-fluorophenyl)-2,6-dihydroxy-5-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)pyrimidin-4(3H)-one
Smiles: Fc1cccc(c1)n1c(O)nc(c(c1=O)C1OC(=O)c2c1cccc2)O

STK589443
Synonyms: 4-(benzylsulfanyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
Smiles: CC1(C)OCc2c(C1)nc(nc2SCc1ccccc1)c1ccccc1

STK589446
Synonyms: 6-chloro-2-oxo-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2H-chromen-7-olate
Smiles: O=c1cc(C[NH+]2CCN(CC2)c2ccccc2)c2c(o1)cc(c(c2)Cl)[O-]

STK851127
Synonyms: 4-[4-phenyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]benzene-1,3-diol
Smiles: Oc1ccc(c(c1)O)c1onc(c1c1ccccc1)C(F)(F)F

STK589448
Synonyms: N-(2,3-dimethylphenyl)-2-{[4-(4-methoxyphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2C)C)nnc1c1ccccn1

STK589452
Synonyms: 5,6-dimethyl-7-(4-methylpiperazin-1-yl)-3-phenylpyrazolo[1,5-a]pyrimidine
Smiles: CN1CCN(CC1)c1c(C)c(C)nc2n1ncc2c1ccccc1

STK589456
Synonyms: 3-(3-hydroxypropyl)-1-methyl-9-(3-methylphenyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1cccc(c1)C

STK589457
Synonyms: 8,10-dimethyl-2-propylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidine-4-thiol
Smiles: CCCc1cc(S)n2c(n1)c1c(C)cc(nc1n2)C

STK589459
Synonyms: N-cyclohexyl-4,5,6-trimethoxy-N-methyl-1H-indole-2-carboxamide
Smiles: COc1cc2[nH]c(cc2c(c1OC)OC)C(=O)N(C1CCCCC1)C

STK589464
Synonyms: 3-(2,6-dichlorobenzyl)-N-(furan-2-ylmethyl)-3H-purin-6-amine
Smiles: Clc1cccc(c1Cn1cnc(c2c1ncn2)NCc1ccco1)Cl

STK589465
Synonyms: 4-{[(1E,2E)-3-(furan-2-yl)-2-methylprop-2-en-1-ylidene]amino}-5-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: C/C(=C\c1ccco1)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)C

STK589469
Synonyms: ethyl4-[(5-{4-[(3,4-dichlorobenzyl)oxy]-2-hydroxyphenyl}-3-methyl-1H-pyrazol-4-yl)oxy]benzoate
Smiles: CCOC(=O)c1ccc(cc1)Oc1c(C)n[nH]c1c1ccc(cc1O)OCc1ccc(c(c1)Cl)Cl

STK589471
Synonyms: 4-hydroxy-8-(2-hydroxyphenyl)-1,7-dimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: Cc1cn2c(n1c1ccccc1O)nc1c2c(O)nc(=O)n1C

STK851131
Synonyms: 1-(4-ethoxyphenyl)-2-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc(cc1)C1N(C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK589475
Synonyms: N'-(5,6-diphenylfuro[2,3-d]pyrimidin-4-yl)-N,N-dimethylethane-1,2-diamine
Smiles: CN(CCNc1ncnc2c1c(c1ccccc1)c(o2)c1ccccc1)C

STK589476
Synonyms: 3-methyl-12-(pyridin-3-yl)-2,3,4,12-tetrahydrobenzimidazo[2,1-b]quinazolin-1-ol
Smiles: CC1CC(=C2C(=Nc3n(C2c2cccnc2)c2c(n3)cccc2)C1)O

STK589477
Synonyms: 8-(2-chlorobenzyl)-4-hydroxy-1,6,7-trimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: Clc1ccccc1Cn1c(C)c(n2c1nc1c2c(O)nc(=O)n1C)C

STK851132
Synonyms: 7-(3,5-dimethylphenyl)-2-(tetrahydrofuran-2-yl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1cc(C)cc(c1)n1ncc2c1ncn1c2nc(n1)C1CCCO1

STK589479
Synonyms: 7-[4-(2,4-dimethylbenzyl)piperazin-1-yl]-2-methyl-3-phenyl-5-(propan-2-yl)pyrazolo[1,5-a]pyrimidine
Smiles: Cc1ccc(c(c1)C)CN1CCN(CC1)c1cc(nc2n1nc(c2c1ccccc1)C)C(C)C

STK589481
Synonyms: (5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-[3-methoxy-4-(3-methylbutoxy)benzylidene]-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: N#CC1=C(C)/C(=C/c2ccc(c(c2)OC)OCCC(C)C)/C(=O)N(C1=O)C1CCS(=O)(=O)C1

STK851134
Synonyms: 3-(2,4-dimethoxyphenyl)-8-(2-methoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: COc1ccc(c(c1)OC)N1CSC2=C(C#N)C(CC(=O)N2C1)c1ccccc1OC

STK589487
Synonyms: N-({4-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)methyl]cyclohexyl}carbonyl)-L-leucine
Smiles: CC(C[C@@H](C(=O)O)NC(=O)C1CCC(CC1)Cn1nnc2c(c1=O)cccc2)C

STK589496
Synonyms: 12-(furan-2-yl)-2-(3-methylphenyl)-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Smiles: Cc1cccc(c1)c1nc2n(n1)cnc1c2C(c2ccco2)C2=C(O1)CCCC2=O

STK851135
Synonyms: 8-(4-hydroxy-3-methoxyphenyl)-3-(4-methylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccc(c(c1)OC)O)c1ccc(cc1)C

STK589501
Synonyms: 3-(5-chloro-2-hydroxy-4-methylphenyl)-4-(2-fluorophenyl)-5-(pyridin-3-ylmethyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: O=C1c2n[nH]c(c2C(N1Cc1cccnc1)c1ccccc1F)c1cc(Cl)c(cc1O)C

STK589504
Synonyms: 4-hydroxy-8-(2-methoxyphenyl)-1,6,7-trimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: COc1ccccc1n1c2nc3c(n2c(c1C)C)c(O)nc(=O)n3C

STK589509
Synonyms: 5-(benzyloxy)-2-[4-(4-methoxyphenyl)-3-(trifluoromethyl)-1,2-oxazol-5-yl]phenol
Smiles: COc1ccc(cc1)c1c(onc1C(F)(F)F)c1ccc(cc1O)OCc1ccccc1

STK589510
Synonyms: 4-amino-N-(4-methoxybenzyl)-3-(4-methoxyphenyl)-2-thioxo-2,3-dihydro-1,3-thiazole-5-carboxamide
Smiles: COc1ccc(cc1)CNC(=O)c1sc(=S)n(c1N)c1ccc(cc1)OC

STK851138
Synonyms: 2-{4-[2-methyl-3-phenyl-5-(propan-2-yl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-yl}ethanol
Smiles: OCCN1CCN(CC1)c1cc(nc2n1nc(c2c1ccccc1)C)C(C)C

STK589513
Synonyms: 3-(2-methoxyethyl)-5-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COCCn1cnc2c(c1=O)n(C)c1c2cccc1

STK589515
Synonyms: 2-[4-(4-chlorophenyl)-3-methyl-1H-pyrazol-5-yl]-5-[(2-methylbenzyl)oxy]phenol
Smiles: Clc1ccc(cc1)c1c(C)n[nH]c1c1ccc(cc1O)OCc1ccccc1C

STK589517
Synonyms: 8-(2,4-dimethoxyphenyl)-1,3,7-trimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1cc(OC)ccc1n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)C

STK589519
Synonyms: N-(2,5-dimethylphenyl)-5-(2-hydroxy-3,4-dimethylphenyl)-1H-pyrazole-3-carboxamide
Smiles: Cc1ccc(c(c1)NC(=O)c1n[nH]c(c1)c1ccc(c(c1O)C)C)C

STK589520
Synonyms: 5-(5-chloro-2-hydroxyphenyl)-N-(4-sulfamoylphenyl)-1H-pyrazole-3-carboxamide
Smiles: Clc1ccc(c(c1)c1[nH]nc(c1)C(=O)Nc1ccc(cc1)S(=O)(=O)N)O

STK589522
Synonyms: (5Z)-3-(2-chlorobenzyl)-2-hydroxy-5-({1-[2-(morpholin-4-yl)-2-oxoethyl]-1H-indol-3-yl}methylidene)-3,5-dihydro-4H-imidazol-4-one
Smiles: OC1=N/C(=C\c2cn(c3c2cccc3)CC(=O)N2CCOCC2)/C(=O)N1Cc1ccccc1Cl

STK851141
Synonyms: ethyl(2E)-2-{[(2E)-3-(4-ethoxyphenyl)prop-2-enoyl]imino}-4-methyl-2,3-dihydro-1,3-thiazole-5-carboxylate
Smiles: CCOc1ccc(cc1)/C=C/C(=O)/N=c\1/sc(c([nH]1)C)C(=O)OCC

STK851144
Synonyms: 7-chloro-2-(3-hydroxypropyl)-1-phenyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: OCCCN1C(=O)c2c(C1c1ccccc1)c(=O)c1c(o2)ccc(c1)Cl

STK589528
Synonyms: N-[(2Z)-3-benzyl-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-(4-chlorophenyl)acetamide
Smiles: O=C(/N=C/1\SC2C(N1Cc1ccccc1)CS(=O)(=O)C2)Cc1ccc(cc1)Cl

STK851146
Synonyms: 3-(2-hydroxyphenyl)-4-(3-methoxyphenyl)-5-[3-(propan-2-yloxy)propyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COc1cccc(c1)C1N(CCCOC(C)C)C(=O)c2c1c([nH]n2)c1ccccc1O

STK851148
Synonyms: 5-tert-butyl-3-(4-chlorophenyl)-7-(3,5-dimethyl-1H-pyrazol-1-yl)pyrazolo[1,5-a]pyrimidine
Smiles: Clc1ccc(cc1)c1cnn2c1nc(cc2n1nc(cc1C)C)C(C)(C)C

STK589538
Synonyms: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(4-fluorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccc(cc1)c1n[nH]c(=S)n1c1ccc2c(c1)OCCO2

STK589539
Synonyms: (3R)-N-(4-chlorobenzyl)-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: Clc1ccc(cc1)CNC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1

STK851151
Synonyms: 3-(2-methoxyphenyl)-2,5-dimethyl-N-(pyridin-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: COc1ccccc1c1c(C)nn2c1nc(C)cc2Nc1ccncc1

STK589542
Synonyms: (1S,2S)-N'-[(E)-(5-bromo-2-hydroxyphenyl)methylidene]-2-phenylcyclopropanecarbohydrazide
Smiles: O=C([C@H]1C[C@@H]1c1ccccc1)N/N=C/c1cc(Br)ccc1O

STK589543
Synonyms: 6-(furan-2-yl)-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)c1ccco1

STK589545
Synonyms: 3-(4-acetylpiperazin-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)C

STK589547
Synonyms: 2-(5-oxo-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-6(5H)-yl)-N-(propan-2-yl)acetamide
Smiles: CC(NC(=O)Cn1c2ccccc2c2c1c(=O)n1CCSc1n2)C

STK589550
Synonyms: N'-[3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-(4-methylphenyl)propyl]-N,N-dimethylethane-1,2-diamine
Smiles: CN(CCNCCC(c1ccc(cc1)C)C1CCOC(C1)(C)C)C

STK589552
Synonyms: methylN-[(thiophen-2-ylmethyl)carbamoyl]-L-methioninate
Smiles: CSCC[C@@H](C(=O)OC)NC(=O)NCc1cccs1

STK589555
Synonyms: N-{3-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]propanoyl}glycine
Smiles: O=C(CCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)NCC(=O)O

STK851155
Synonyms: (5Z)-5-(3-bromobenzylidene)-3-[2-oxo-2-(piperidin-1-yl)ethyl]-2-thioxo-1,3-thiazolidin-4-one
Smiles: Brc1cccc(c1)/C=C/1\SC(=S)N(C1=O)CC(=O)N1CCCCC1

STK589560
Synonyms: ethyl3-methyl-4-oxo-4,7-dihydro-5H-thiopyrano[3,4-b]furan-2-carboxylate
Smiles: CCOC(=O)c1oc2c(c1C)C(=O)CSC2

STK589562
Synonyms: N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(tetrahydrofuran-2-ylmethyl)methanesulfonamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(S(=O)(=O)C)CC1CCCO1

STK589565
Synonyms: 5-(furan-2-yl)-4-imino-3-(2-methylpropyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol
Smiles: Oc1ccc2c(c1)Oc1c(C2c2ccco2)c(=N)n(cn1)CC(C)C

STK589567
Synonyms: 2-[2-amino-5-(4-chlorophenyl)-6-methylpyrimidin-4-yl]-5-[(2,6-dichlorobenzyl)oxy]phenol
Smiles: Clc1ccc(cc1)c1c(C)nc(nc1c1ccc(cc1O)OCc1c(Cl)cccc1Cl)N

STK589570
Synonyms: 6-chloro-4-{[4-(2-methoxyphenyl)piperazin-1-yl]methyl}-2H-chromen-2-one
Smiles: COc1ccccc1N1CCN(CC1)Cc1cc(=O)oc2c1cc(Cl)cc2

STK589572
Synonyms: ethyl4-{[(4-fluorophenyl)sulfonyl]amino}-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c(C)n(c2c1c(NS(=O)(=O)c1ccc(cc1)F)c(OC)cc2)C

STK851156
Synonyms: N-{3-[(3-methoxypropyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-4-oxo-4H-chromene-2-carboxamide
Smiles: COCCCNC(=O)c1c(sc2c1CCCC2)NC(=O)c1cc(=O)c2c(o1)cccc2

STK589574
Synonyms: ethyl[1-(4-fluorobenzyl)-5-oxo-2-phenyl-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl]carbamate
Smiles: CCOC(=O)NC1(N=C(N(C1=O)Cc1ccc(cc1)F)c1ccccc1)C(F)(F)F

STK589579
Synonyms: methyl4,5-dimethoxy-2-({(3Z)-3-[(methylsulfonyl)imino]-3,4-dihydroquinoxalin-2-yl}amino)benzoate
Smiles: COC(=O)c1cc(OC)c(cc1Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)C)OC

STK589580
Synonyms: 6-hydroxy-8-(3-hydroxyphenyl)-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: Oc1cccc(c1)c1[nH]c2c(n1)n(C)c(=O)nc2O

STK589583
Synonyms: (4E)-5-(2,4-dimethoxyphenyl)-4-[hydroxy(phenyl)methylidene]-1-(4-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)N1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccc(cc1OC)OC

STK851157
Synonyms: 4-(4-chlorophenyl)-2-[(4-methoxyphenyl)amino]-8-methyl-4H-pyrimido[1,2-a][1,3,5]triazin-6-ol
Smiles: COc1ccc(cc1)NC1=NC(n2c(=N1)nc(C)cc2O)c1ccc(cc1)Cl

STK851158
Synonyms: 2-[2-amino-5-(4-chlorophenyl)-6-methylpyrimidin-4-yl]-5-ethoxyphenol
Smiles: CCOc1ccc(c(c1)O)c1nc(N)nc(c1c1ccc(cc1)Cl)C

STK589585
Synonyms: N-butyl-7-[3-(dimethylamino)propyl]-5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Smiles: CCCCNc1ncnc2c1c(C)c(n2CCCN(C)C)C

STK589588
Synonyms: 2-[3-(1H-pyrazol-5-yl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]propanoicacid
Smiles: CC(n1c(n[nH]c1=S)c1ccn[nH]1)C(=O)O

STK851159
Synonyms: 4-oxo-N-[2-(4-sulfamoylphenyl)ethyl]-4H-chromene-2-carboxamide
Smiles: O=C(c1cc(=O)c2c(o1)cccc2)NCCc1ccc(cc1)S(=O)(=O)N

STK589593
Synonyms: ethyl1-[3-(1H-benzimidazol-2-yl)propanoyl]piperidine-3-carboxylate
Smiles: CCOC(=O)C1CCCN(C1)C(=O)CCc1nc2c([nH]1)cccc2

STK851160
Synonyms: [4-(2,5-dimethylphenyl)piperazin-1-yl][3-(5-methyl-2H-tetrazol-2-yl)tricyclo[3.3.1.1~3,7~]dec-1-yl]methanone
Smiles: Cc1ccc(c(c1)N1CCN(CC1)C(=O)C12CC3CC(C1)CC(C2)(C3)n1nnc(n1)C)C

STK589601
Synonyms: 1-(1-{6-[(4-methoxyphenyl)amino]-2-methylpyrimidin-4-yl}-5-methyl-1H-pyrazol-4-yl)ethanone
Smiles: COc1ccc(cc1)Nc1nc(C)nc(c1)n1ncc(c1C)C(=O)C

STK589602
Synonyms: 3-(1H-benzimidazol-2-yl)-1-[4-(3-chlorophenyl)piperazin-1-yl]propan-1-one
Smiles: Clc1cccc(c1)N1CCN(CC1)C(=O)CCc1nc2c([nH]1)cccc2

STK589605
Synonyms: N-(2-benzyl-5-hydroxy[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)cyclohexanecarboxamide
Smiles: Oc1cc(NC(=O)C2CCCCC2)n2c(n1)nc(n2)Cc1ccccc1

STK589608
Synonyms: 7,8-dimethyl-4-[(4-methylpiperidin-1-yl)methyl]-2H-chromen-2-one
Smiles: CC1CCN(CC1)Cc1cc(=O)oc2c1ccc(c2C)C

STK589610
Synonyms: (2E)-2-cyano-N-(1,1-dioxidotetrahydrothiophen-3-yl)-3-[5-(piperidin-1-yl)furan-2-yl]prop-2-enamide
Smiles: N#C/C(=C\c1ccc(o1)N1CCCCC1)/C(=O)NC1CCS(=O)(=O)C1

STK851163
Synonyms: 4-(5-chloro-2-methoxyphenyl)-5-(quinolin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1n1c(=S)[nH]nc1c1ccc2c(n1)cccc2)Cl

STK589611
Synonyms: 5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-hydroxy-3,5-dimethylphenyl)-4-(3-hydroxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COc1ccc(cc1OC)CCN1C(=O)c2c(C1c1cccc(c1)O)c([nH]n2)c1cc(C)cc(c1O)C

STK589614
Synonyms: 6-hydroxy-3-methyl-8-[4-(2-methylbenzyl)piperazin-1-yl]-7-(2-methylpropyl)-3,7-dihydro-2H-purin-2-one
Smiles: CC(Cn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1ccccc1C)C

STK851165
Synonyms: 2-{4-[5-methyl-3-phenyl-6-(prop-2-en-1-yl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-yl}ethanol
Smiles: OCCN1CCN(CC1)c1c(CC=C)c(C)nc2n1ncc2c1ccccc1

STK589617
Synonyms: (2Z)-6-[(2-chloro-6-fluorobenzyl)oxy]-2-(pyridin-4-ylmethylidene)-1-benzofuran-3(2H)-one
Smiles: O=C1/C(=C/c2ccncc2)/Oc2c1ccc(c2)OCc1c(F)cccc1Cl

STK589618
Synonyms: 5-benzyl-2-(4-benzylpiperazin-1-yl)pyrimidine-4,6-diol
Smiles: Oc1nc(nc(c1Cc1ccccc1)O)N1CCN(CC1)Cc1ccccc1

STK589625
Synonyms: N-[2-(4-chlorophenyl)-5-hydroxy[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]propanamide
Smiles: CCC(=O)Nc1cc(O)nc2n1nc(n2)c1ccc(cc1)Cl

STK589626
Synonyms: N-[3-(1,3-benzodioxol-5-ylmethyl)-2',6'-dihydroxy-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl]acetamide
Smiles: OC1=NC(=O)C2(C(=N1)O)Cc1cc(ccc1N1C2CN(CC1)Cc1ccc2c(c1)OCO2)NC(=O)C

STK589627
Synonyms: (1Z)-1-[(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)methylidene]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc2CCN/C(=C\S(=O)(=O)c3ccc4c(c3)OCCO4)/c2cc1OC

STK851168
Synonyms: 3-(3-hydroxypropyl)-1-methyl-8-phenyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccccc1

STK589635
Synonyms: 4-hydroxy-1-phenyl-6-sulfanyl-2-(thiophen-2-yl)-1,2-dihydropyrimidine-5-carbonitrile
Smiles: N#CC1=C(S)N(C(N=C1O)c1cccs1)c1ccccc1

STK589637
Synonyms: 6-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-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)c1n2CC(=O)N1CCC(CC1)Cc1ccccc1

STK589639
Synonyms: 3-[6-(4-benzylpiperidin-1-yl)-6-oxohexyl]quinazolin-4(3H)-one
Smiles: O=C(N1CCC(CC1)Cc1ccccc1)CCCCCn1cnc2c(c1=O)cccc2

STK589640
Synonyms: 3-(4-ethylphenyl)-6-hydroxy-1',6'-dimethyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4(3H)-dione
Smiles: CCc1ccc(cc1)N1C(=O)N=C(C2(C1=O)CN(C)c1c(C2)cc(cc1)C)O

STK851170
Synonyms: 4-(3-chlorophenyl)-3-(2-hydroxyphenyl)-5-(3-methoxypropyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COCCCN1C(=O)c2c(C1c1cccc(c1)Cl)c([nH]n2)c1ccccc1O

STK851171
Synonyms: 2,8,10-trimethyl-N-(1-phenylethyl)pyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-4-amine
Smiles: Cc1cc(NC(c2ccccc2)C)n2c(n1)c1c(C)cc(nc1n2)C

STK589646
Synonyms: (3S)-N-[(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: O=C([C@@H](NC(=O)[C@H]1NCc2c(C1)cccc2)C)NC1CCCCC1

STK851173
Synonyms: 3-(2-hydroxyphenyl)-5-(3-methoxypropyl)-4-[4-(methylsulfanyl)phenyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COCCCN1C(=O)c2c(C1c1ccc(cc1)SC)c([nH]n2)c1ccccc1O

STK589658
Synonyms: (5E)-4-hydroxy-5-{[1-(prop-2-en-1-yl)-1H-indol-3-yl]methylidene}-1,5-dihydro-2H-imidazol-2-one
Smiles: C=CCn1cc(c2c1cccc2)/C=C\1/NC(=O)N=C1O

STK851176
Synonyms: (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-3-[4-(diethylamino)phenyl]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCN(c1ccc(cc1)N1C(=S)S/C(=C\c2nc3c([nH]2)cccc3)/C1=O)CC

STK851177
Synonyms: 1-benzyl-7-methyl-4-oxo-N-[3-(propan-2-yloxy)propyl]-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: CC(OCCCNC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cc(cc1)C)C

STK851178
Synonyms: (4Z)-4-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]methylidene}-2-phenylisoquinoline-1,3(2H,4H)-dione
Smiles: O=C1/C(=C\Nc2c(=O)n(n(c2C)C)c2ccccc2)/c2ccccc2C(=O)N1c1ccccc1

STK589663
Synonyms: 2-methyl-7-(4-methylpiperazin-1-yl)-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidine
Smiles: CCCc1cc(N2CCN(CC2)C)n2c(n1)c(c1ccccc1)c(n2)C

STK851180
Synonyms: 7-(furan-2-yl)-2-hydroxy-5-oxo-N-phenyl-3,4,5,6,7,8-hexahydroquinoline-4-carboxamide
Smiles: OC1=NC2=C(C(C1)C(=O)Nc1ccccc1)C(=O)CC(C2)c1ccco1

STK851181
Synonyms: 5-tert-butyl-3-(2-chlorophenyl)-N-[3-(1H-imidazol-1-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: Clc1ccccc1c1cnn2c1nc(cc2NCCCn1cncc1)C(C)(C)C

STK589668
Synonyms: 3-(4-bromophenyl)-7-[(2-chloro-4-fluorobenzyl)oxy]-4H-chromen-4-one
Smiles: Brc1ccc(cc1)c1coc2c(c1=O)ccc(c2)OCc1ccc(cc1Cl)F

STK851184
Synonyms: 6,7-dimethoxy-3-propyl-2-sulfanylquinazolin-4(3H)-one
Smiles: CCCn1c(S)nc2c(c1=O)cc(c(c2)OC)OC

STK851185
Synonyms: 2-{4-[5-tert-butyl-3-(4-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-yl}ethanol
Smiles: OCCN1CCN(CC1)c1cc(nc2n1ncc2c1ccc(cc1)Cl)C(C)(C)C

STK851186
Synonyms: 3-(3,4-dimethoxyphenyl)-7-[(2,5-dimethylbenzyl)oxy]-4H-chromen-4-one
Smiles: COc1cc(ccc1OC)c1coc2c(c1=O)ccc(c2)OCc1cc(C)ccc1C

STK589675
Synonyms: 6-amino-1-(4-methoxybenzyl)-2-sulfanylpyrimidin-4(1H)-one
Smiles: COc1ccc(cc1)Cn1c(N)cc(=O)nc1S

STK589680
Synonyms: 4-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-2-propylpyridine
Smiles: CCCc1nccc(c1)c1scc(n1)c1cccc(c1)OC

STK589682
Synonyms: 2-(4-oxo-6,7-dihydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-3(5H)-yl)butanoicacid
Smiles: CCC(n1cnc2c(c1=O)c1CCCc1s2)C(=O)O

STK589684
Synonyms: 2-ethyl-5-methyl-7-[4-(2-methylprop-2-en-1-yl)piperazin-1-yl]-3-phenylpyrazolo[1,5-a]pyrimidine
Smiles: CCc1nn2c(c1c1ccccc1)nc(cc2N1CCN(CC1)CC(=C)C)C

STK851188
Synonyms: 8-(diethylamino)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN(c1nc2c(n1CC(COc1ccccc1)O)c(=O)n(c(=O)n2C)C)CC

STK589687
Synonyms: N-{[2-(4-chlorophenyl)ethyl]carbamoyl}-L-valine
Smiles: CC([C@@H](C(=O)O)NC(=O)NCCc1ccc(cc1)Cl)C

STK589691
Synonyms: 9-(3,4-dimethoxyphenyl)-6-(furan-2-yl)-2-methyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1ccc(cc1OC)C1C2=C(O)CC(CC2=Nc2n1nc(n2)C)c1ccco1

STK851189
Synonyms: 4-(4-bromophenyl)-4H-1,2,4-triazole
Smiles: Brc1ccc(cc1)n1cnnc1

STK589694
Synonyms: 4-(5-bromo-1-benzofuran-2-yl)-7,8-dihydrocyclopenta[g]chromen-2(6H)-one
Smiles: Brc1ccc2c(c1)cc(o2)c1cc(=O)oc2c1cc1CCCc1c2

STK589696
Synonyms: 5-tert-butyl-3-(4-chlorophenyl)-N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: CC(CNc1cc(nc2n1ncc2c1ccc(cc1)Cl)C(C)(C)C)C

STK851190
Synonyms: 3-(2-methylphenyl)-6-oxo-8-(3,4,5-trimethoxyphenyl)-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1cc(OC)c(c(c1)OC)OC)c1ccccc1C

STK589701
Synonyms: (3E)-3-[2-oxo-2-(pyridin-3-yl)ethylidene]-1,3-dihydro-2H-indol-2-one
Smiles: O=C(c1cccnc1)/C=C\1/C(=O)Nc2c1cccc2

STK589702
Synonyms: 8-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-1,7-dimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: COc1cc(ccc1OC)CCn1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK589707
Synonyms: 3-[(5Z)-5-(4-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[2-(4-hydroxyphenyl)ethyl]propanamide
Smiles: O=C(CCN1C(=S)S/C(=C\c2ccc(cc2)F)/C1=O)NCCc1ccc(cc1)O

STK589711
Synonyms: 7-cyclohexyl-N~5~-[2-(3,4-dimethoxyphenyl)ethyl]-6,7,8,9-tetrahydro-3H-pyrazolo[3,4-c][2,7]naphthyridine-1,5-diamine
Smiles: COc1cc(CCNc2nc3[nH]nc(c3c3c2CN(CC3)C2CCCCC2)N)ccc1OC

STK589719
Synonyms: (5Z)-3-cyclohexyl-5-[1-(cyclopropylamino)propylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CC/C(=C/1\C(=NC(=O)N(C1=O)C1CCCCC1)O)/NC1CC1

STK589723
Synonyms: tert-butyl(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
Smiles: O=C([C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)Nc1ccc2c(c1)OCCO2

STK589724
Synonyms: N-[(3-methylphenyl)carbamoyl]valine
Smiles: O=C(NC(C(=O)O)C(C)C)Nc1cccc(c1)C

STK851191
Synonyms: 3-(4-chlorophenyl)-N-(4-methoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-amine
Smiles: COc1ccc(cc1)Nc1cc(C)nc2n1ncc2c1ccc(cc1)Cl

STK589726
Synonyms: 3-(4-chlorophenyl)-5-methyl-7-[4-(pyridin-2-yl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine
Smiles: Clc1ccc(cc1)c1cnn2c1nc(C)cc2N1CCN(CC1)c1ccccn1

STK589727
Synonyms: propan-2-yl{[5-(3-chlorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Smiles: CC(OC(=O)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl)C

STK851193
Synonyms: 2-[(3-chlorophenoxy)methyl]-5-[(pyridin-3-ylmethyl)amino]-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1NCc1cccnc1)COc1cccc(c1)Cl

STK851194
Synonyms: 2-[5-(3,4-dimethoxyphenyl)pyrimidin-4-yl]-5-[(2-methylbenzyl)oxy]phenol
Smiles: COc1cc(ccc1OC)c1cncnc1c1ccc(cc1O)OCc1ccccc1C

STK851195
Synonyms: 3-(2-methoxyphenyl)-5-methyl-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: COc1ccccc1c1cnn2c1nc(C)cc2NCc1ccccn1

STK589732
Synonyms: 8-bromo-6-hydroxy-7-(2-methoxyethyl)-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: Cn1c2nc(n(c2c(nc1=O)O)CCOC)Br

STK589735
Synonyms: 5-(1-{[4-(diethylamino)phenyl]amino}ethylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCN(c1ccc(cc1)NC(=C1C(=O)N(C)C(=O)N(C1=O)C)C)CC

STK589736
Synonyms: 11-(furan-2-yl)-10-methyl-2-(3-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1cccc(c1)c1nc2n(n1)cnc1c2C(c2ccco2)c2c(O1)n(nc2C)c1ccccc1

STK589737
Synonyms: 2-(benzylsulfanyl)-9-(4-hydroxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Oc1ccc(cc1)C1C2=C(O)CCCC2=Nc2n1nc(n2)SCc1ccccc1

STK851197
Synonyms: 1-benzyl-N-(4-chlorophenyl)-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1

STK589745
Synonyms: 4-(5-{(E)-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazinylidene]methyl}furan-2-yl)benzenesulfonamide
Smiles: NS(=O)(=O)c1ccc(cc1)c1ccc(o1)/C=N/Nc1ncnc2c1c(cs2)c1ccccc1

STK851202
Synonyms: 5-[4-(benzyloxy)phenyl]-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
Smiles: Nc1nc2n(n1)c(cc(n2)c1ccc(cc1)OCc1ccccc1)C(F)(F)F

STK589748
Synonyms: (5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-6-hydroxy-3-(thiophen-2-ylmethyl)pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C/c2cc(n(c2C)c2ccccc2)C)/C(=O)N1Cc1cccs1

STK589754
Synonyms: N-[(Z)-(4,6-dioxo-1-phenyl-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]tyrosine
Smiles: Oc1ccc(cc1)CC(C(=O)O)N/C=C\1/C(=O)NC(=S)N(C1=O)c1ccccc1

STK589757
Synonyms: 1-ethyl-4,6-dihydroxypyrimidin-2(1H)-one
Smiles: CCn1c(O)cc(nc1=O)O

STK589759
Synonyms: methyl4-[2-(4-methoxybenzyl)-3,9-dioxo-1,2,3,9-tetrahydrochromeno[2,3-c]pyrrol-1-yl]benzoate
Smiles: COc1ccc(cc1)CN1C(=O)c2c(C1c1ccc(cc1)C(=O)OC)c(=O)c1c(o2)cccc1

STK589763
Synonyms: N-{4-[(2-ethylpiperidin-1-yl)sulfonyl]phenyl}-5-(2-hydroxy-5-methylphenyl)-1H-pyrazole-3-carboxamide
Smiles: CCC1CCCCN1S(=O)(=O)c1ccc(cc1)NC(=O)c1n[nH]c(c1)c1cc(C)ccc1O

STK589766
Synonyms: N-(2-benzyl-5-hydroxy[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-3-chlorobenzamide
Smiles: Clc1cccc(c1)C(=O)Nc1cc(O)nc2n1nc(n2)Cc1ccccc1

STK589767
Synonyms: 6-hydroxy-8-[4-(2-hydroxyethyl)piperazin-1-yl]-7-[2-(4-methoxyphenyl)ethyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: OCCN1CCN(CC1)c1nc2c(n1CCc1ccc(cc1)OC)c(O)nc(=O)n2C

STK589769
Synonyms: 2-(3-bromo-5-ethoxy-4-hydroxyphenyl)-4-imino-6,7,11,12-tetrahydro-4H,10H-[1,4]dioxepino[2,3-g]pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: CCOc1cc(cc(c1O)Br)c1cc2c3cc4OCCCOc4cc3CCn2c(=N)c1C#N

STK589772
Synonyms: 3-[2-(diethylamino)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol
Smiles: CCN(CCn1cnc2c(c1=N)C(c1ccc(cc1)OC)c1c(O2)cc(cc1)O)CC

STK851204
Synonyms: 3-(2-ethoxyphenoxy)-4-oxo-4H-chromen-7-yl4-nitrobenzoate
Smiles: CCOc1ccccc1Oc1coc2c(c1=O)ccc(c2)OC(=O)c1ccc(cc1)[N+](=O)[O-]

STK851205
Synonyms: N-[4-(3,4-dimethoxyphenyl)-1,2,5-oxadiazol-3-yl]-2-(2,3-dimethylphenoxy)propanamide
Smiles: COc1cc(ccc1OC)c1nonc1NC(=O)C(Oc1cccc(c1C)C)C

STK589788
Synonyms: 5-[(2,5-dimethylbenzyl)oxy]-2-[5-(4-methoxyphenyl)pyrimidin-4-yl]phenol
Smiles: COc1ccc(cc1)c1cncnc1c1ccc(cc1O)OCc1cc(C)ccc1C

STK589791
Synonyms: 6-tert-butyl-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: [O-][N+](=O)c1cc(ccc1C)c1c2c(=O)n(C)c(=O)n(c2cn1C(C)(C)C)C

STK851206
Synonyms: N-[(2E)-4-hydroxy-1,3-thiazol-2(5H)-ylidene]-2-[(4-methylphenyl)sulfanyl]acetamide
Smiles: O=C(/N=C\1/SCC(=N1)O)CSc1ccc(cc1)C

STK851207
Synonyms: 3-(2,4-dimethoxyphenyl)-8-(3,4-dimethoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: COc1ccc(c(c1)OC)N1CSC2=C(C#N)C(CC(=O)N2C1)c1ccc(c(c1)OC)OC

STK589796
Synonyms: 3-(4-chlorophenyl)-4-phenyl-N-(tetrahydrofuran-2-ylmethyl)butan-1-amine
Smiles: Clc1ccc(cc1)C(Cc1ccccc1)CCNCC1CCCO1

STK589797
Synonyms: 7-(4-benzylpiperidin-1-yl)-2-methyl-3-phenyl-5-(propan-2-yl)pyrazolo[1,5-a]pyrimidine
Smiles: CC(c1cc(N2CCC(CC2)Cc2ccccc2)n2c(n1)c(c1ccccc1)c(n2)C)C

STK589799
Synonyms: 7'-{[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]amino}-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=C1OC(C)(C)OC(=O)C1=CNc1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C

STK589800
Synonyms: (3S)-N-{(1R)-2-[(furan-2-ylmethyl)amino]-2-oxo-1-phenylethyl}-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: O=C([C@H]1NCc2c(C1)cccc2)N[C@H](c1ccccc1)C(=O)NCc1ccco1

STK851208
Synonyms: 1-benzyl-N-(4-ethylphenyl)-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: CCc1ccc(cc1)NC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1

STK851209
Synonyms: N-[(2Z)-5-(ethylsulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
Smiles: CCSc1n[nH]/c(=N/C(=O)C(C(F)(F)F)C(F)(F)F)/s1

STK851210
Synonyms: 1-(3-methoxypropyl)-9-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)N

STK589803
Synonyms: 3-(1-methyl-1H-benzimidazol-2-yl)-1-(2-phenylethyl)-1H-pyrrolo[2,3-b]quinoxalin-2-amine
Smiles: Cn1c2ccccc2nc1c1c(N)n(c2c1nc1ccccc1n2)CCc1ccccc1

STK851211
Synonyms: 5-[(2-fluorobenzyl)oxy]-2-[5-(4-methoxyphenoxy)pyrimidin-4-yl]phenol
Smiles: COc1ccc(cc1)Oc1cncnc1c1ccc(cc1O)OCc1ccccc1F

STK589807
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NC(=O)Nc1ccc(c(c1)C)C)C

STK589809
Synonyms: 3-(but-3-en-2-yl)-8-(3,4-dimethylphenyl)-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: C=CC(n1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1ccc(c(c1)C)C)C)C

STK589812
Synonyms: (E)-N-[(8,9-diphenylfuro[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]-1-(2-methoxyphenyl)methanimine
Smiles: COc1ccccc1/C=N/OCc1nn2c(n1)c1c(nc2)oc(c1c1ccccc1)c1ccccc1

STK589818
Synonyms: furan-2-yl{4-[(6-methoxy-1H-indol-2-yl)carbonyl]piperazin-1-yl}methanone
Smiles: COc1ccc2c(c1)[nH]c(c2)C(=O)N1CCN(CC1)C(=O)c1ccco1

STK589821
Synonyms: 7-benzyl-6-hydroxy-3-methyl-8-(morpholin-4-ylmethyl)-3,7-dihydro-2H-purin-2-one
Smiles: Oc1nc(=O)n(c2c1n(Cc1ccccc1)c(n2)CN1CCOCC1)C

STK851213
Synonyms: 7-(2-chlorophenyl)-2-(pyridin-3-yl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Clc1ccccc1n1ncc2c1ncn1c2nc(n1)c1cccnc1

STK589822
Synonyms: 4-chloro-N'-{4-[(5Z)-5-(4-methylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}benzohydrazide
Smiles: O=C(NNC(=O)c1ccc(cc1)Cl)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK589825
Synonyms: N-[5-hydroxy-2-(2-phenylethyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)Nc1cc(O)nc2n1nc(n2)CCc1ccccc1

STK589827
Synonyms: ethyl4-{[(4-methoxy-1H-indol-2-yl)carbonyl]amino}piperidine-1-carboxylate
Smiles: CCOC(=O)N1CCC(CC1)NC(=O)c1cc2c([nH]1)cccc2OC

STK589828
Synonyms: 6-ethyl-4-{[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl}-2-oxo-2H-chromen-7-olate
Smiles: CCc1cc2c(cc1[O-])oc(=O)cc2C[NH+]1CCN(CC1)c1ccc(cc1)F

STK589829
Synonyms: 4-{[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]amino}-5-(3-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cccc(c1)c1n[nH]c(=S)n1/N=C/C=C/c1ccco1

STK589832
Synonyms: 7-chloro-1-(3-hydroxyphenyl)-2-(3-hydroxypropyl)-6-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: OCCCN1C(=O)c2c(C1c1cccc(c1)O)c(=O)c1c(o2)cc(c(c1)Cl)C

STK589833
Synonyms: 5-[(2-fluorobenzyl)oxy]-2-[4-(3-methoxyphenoxy)-3-methyl-1H-pyrazol-5-yl]phenol
Smiles: COc1cccc(c1)Oc1c(C)n[nH]c1c1ccc(cc1O)OCc1ccccc1F

STK589834
Synonyms: 3-[(7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)sulfanyl]propane-1,2-diol
Smiles: OCC(CSc1nc(nc2c1COC(C2)(C)C)c1ccccc1)O

STK589840
Synonyms: 2-butoxy-N-[4-(3,4-dimethoxyphenyl)-1,2,5-oxadiazol-3-yl]benzamide
Smiles: CCCCOc1ccccc1C(=O)Nc1nonc1c1ccc(c(c1)OC)OC

STK589844
Synonyms: 4-[(3-oxo-1,3-dihydro-2-benzofuran-1-yl)amino]-N-(1,3-thiazol-2-yl)benzenesulfonamide
Smiles: O=C1OC(c2c1cccc2)Nc1ccc(cc1)S(=O)(=O)Nc1nccs1

STK851216
Synonyms: N-(1,3-benzodioxol-5-yl)-1-benzyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: O=c1c2cc(n(c2nc2n1cccc2)Cc1ccccc1)C(=O)Nc1ccc2c(c1)OCO2

STK589845
Synonyms: 8-(4-chlorophenyl)-11-(furan-2-yl)-10-methyl-2-(pyridin-3-yl)-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Clc1ccc(cc1)n1nc(c2c1Oc1ncn3c(c1C2c1ccco1)nc(n3)c1cccnc1)C

STK589846
Synonyms: 2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl(4-ethylpiperazin-1-yl)methanone
Smiles: CCN1CCN(CC1)C(=O)c1c2CCCc2nc2c1cccc2

STK589848
Synonyms: 9-(4-benzylpiperazin-1-yl)-2-methyl-3-phenyl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazoline
Smiles: Cc1nn2c(c1c1ccccc1)nc1c(c2N2CCN(CC2)Cc2ccccc2)CCCC1

STK589850
Synonyms: 4-(9-methyl-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline
Smiles: CN1CCc2c(C1)sc1c2c2nc(nn2cn1)c1ccc(cc1)N

STK851217
Synonyms: 3-(2-hydroxyphenyl)-4-(4-methoxyphenyl)-5-[2-(4-methoxyphenyl)ethyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COc1ccc(cc1)CCN1C(=O)c2c(C1c1ccc(cc1)OC)c([nH]n2)c1ccccc1O

STK589853
Synonyms: N-[3-(ethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-(2-hydroxyphenyl)-1H-pyrazole-3-carboxamide
Smiles: CCNC(=O)c1c(NC(=O)c2n[nH]c(c2)c2ccccc2O)sc2c1CCCC2

STK589854
Synonyms: (2E)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-ethylbenzyl)-3-(4-methylphenyl)prop-2-enamide
Smiles: CCc1ccc(cc1)CN(C1CCS(=O)(=O)C1)C(=O)/C=C/c1ccc(cc1)C

STK589855
Synonyms: 3-butyl-5-[(2E)-3-(2,6-dichlorophenyl)prop-2-enoyl]-2,6-dihydroxypyrimidin-4(3H)-one
Smiles: CCCCn1c(O)nc(c(c1=O)C(=O)/C=C/c1c(Cl)cccc1Cl)O

STK851220
Synonyms: 5-tert-butyl-N-(2-methylpropyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7-amine
Smiles: CC(CNc1cc(nc2n1ncc2c1ccccc1)C(C)(C)C)C

STK589856
Synonyms: 2-{(2E)-[(2-methyl-2H-chromen-3-yl)methylidene]hydrazinylidene}-2,3-dihydro-1H-benzimidazole
Smiles: CC1Oc2ccccc2C=C1/C=N/N=c/1\[nH]c2c([nH]1)cccc2

STK589857
Synonyms: 2,4-dimethyl-1,3-oxazole-5-carboxylicacid
Smiles: Cc1nc(c(o1)C(=O)O)C

STK589858
Synonyms: 7-methyl-3-[(propylamino)methyl]quinolin-2(1H)-one
Smiles: CCCNCc1cc2ccc(cc2[nH]c1=O)C

STK589859
Synonyms: 6-(furan-2-yl)-9-(4-methoxyphenyl)-2-methyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2n1nc(n2)C)c1ccco1

STK851221
Synonyms: N-[4-(morpholin-4-ylsulfonyl)phenyl]-4-oxo-4H-chromene-2-carboxamide
Smiles: O=C(c1cc(=O)c2c(o1)cccc2)Nc1ccc(cc1)S(=O)(=O)N1CCOCC1

STK589862
Synonyms: 4-({(1E)-1-[4-hydroxy-1-(2-methylphenyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]ethyl}amino)benzoicacid
Smiles: O=C1N=C(O)/C(=C(\Nc2ccc(cc2)C(=O)O)/C)/C(=O)N1c1ccccc1C

STK589864
Synonyms: 2-[(2,3-dimethylphenoxy)methyl]-9-methyl-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CN1CCc2c(C1)sc1c2c2nc(nn2cn1)COc1cccc(c1C)C

STK589868
Synonyms: 3-[1-(2-chloro-6-fluorophenyl)-2-nitroethyl]-1H-indole
Smiles: [O-][N+](=O)CC(c1c[nH]c2c1cccc2)c1c(F)cccc1Cl

STK589870
Synonyms: 7-(3,4-dimethylphenyl)-3-(3-nitrophenyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-6,8-dione
Smiles: O=C1CC2(C(=O)N1c1ccc(c(c1)C)C)ON=C(C2)c1cccc(c1)[N+](=O)[O-]

STK589877
Synonyms: 4-(4-chlorophenyl)-6-hydroxy-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
Smiles: N#Cc1c(O)nc2c(c1c1ccc(cc1)Cl)c(C)nn2c1ccccc1

STK589880
Synonyms: N-{[2-methyl-5-(4-oxo-3,4-dihydrophthalazin-1-yl)phenyl]carbamoyl}-L-phenylalanine
Smiles: O=C(Nc1cc(ccc1C)c1n[nH]c(=O)c2c1cccc2)N[C@H](C(=O)O)Cc1ccccc1

STK589885
Synonyms: methylN-{[3-(1,3-benzoxazol-2-yl)phenyl]carbamoyl}-L-valinate
Smiles: COC(=O)[C@H](C(C)C)NC(=O)Nc1cccc(c1)c1nc2c(o1)cccc2

STK589887
Synonyms: 6-chloro-N-{3-[(3-ethoxypropyl)carbamoyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl}-7-methyl-4-oxo-4H-chromene-2-carboxamide
Smiles: CCOCCCNC(=O)c1c(NC(=O)c2cc(=O)c3c(o2)cc(c(c3)Cl)C)sc2c1CCC2

STK589891
Synonyms: ethyl4-methyl-2-{[(2E)-4,6,8-trimethylquinazolin-2(1H)-ylidene]amino}pyrimidine-5-carboxylate
Smiles: CCOC(=O)c1cnc(nc1C)/N=c\1/nc(C)c2c([nH]1)c(C)cc(c2)C

STK589893
Synonyms: N-[(3,4-dichlorophenyl)carbamoyl]-D-valine
Smiles: O=C(N[C@@H](C(=O)O)C(C)C)Nc1ccc(c(c1)Cl)Cl

STK589894
Synonyms: 4-[4-methoxy-2-(prop-2-en-1-yl)phenoxy][1,2,4]triazolo[4,3-a]quinoxaline
Smiles: C=CCc1cc(OC)ccc1Oc1nc2ccccc2n2c1nnc2

STK589896
Synonyms: N-(3-bromobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(3-methylphenoxy)acetamide
Smiles: Cc1cccc(c1)OCC(=O)N(C1CCS(=O)(=O)C1)Cc1cccc(c1)Br

STK589903
Synonyms: 2,2,5-trimethyl-N-(pyridin-3-ylmethyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-amine
Smiles: Cc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCc1cccnc1

STK851227
Synonyms: furan-2-yl[4-(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]methanone
Smiles: Cc1nc2ncnn2c(c1)N1CCN(CC1)C(=O)c1ccco1

STK589905
Synonyms: 4,4-dimethyl-7'-nitro-1',2',3',3a'-tetrahydro-2H,5'H,6H-spiro[cyclohexane-1,4'-pyrrolo[1,2-a]quinoline]-2,6-dione
Smiles: O=C1CC(C)(C)CC(=O)C21Cc1cc(ccc1N1C2CCC1)[N+](=O)[O-]

STK589910
Synonyms:
Smiles: CCC([C@@H](C(=O)N1CCC(CC1)C(=O)O)NC(=O)N1CC(=Nc2c1cccc2)O)C

STK851230
Synonyms: ethylN-[(1-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-2-yl)carbonyl]glycinate
Smiles: CCOC(=O)CNC(=O)c1cc2c(n1C)nc1n(c2=O)cccc1

STK851231
Synonyms: N-[2-(morpholin-4-yl)ethyl]-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidin-7-amine
Smiles: CCCc1cc(NCCN2CCOCC2)n2c(n1)c(cn2)c1ccccc1

STK851232
Synonyms: 5-propyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(3H)-one
Smiles: CCCc1cc(=O)n2c(n1)[nH]c(n2)c1cccnc1

STK589925
Synonyms: ethyl4-{[(2,4-dimethylphenyl)sulfonyl]amino}-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c2c(NS(=O)(=O)c3ccc(cc3C)C)c(OC)ccc2n(c1C)C

STK851236
Synonyms: 8-(1H-imidazol-1-yl)-2-methyl-3-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrazolo[1,5-a]pyrimidine
Smiles: Cc1nn2c(c1c1ccccc1)nc1c(c2n2cncc2)CCC1

STK589928
Synonyms: N-[2-(1H-indol-3-yl)ethyl]-2-[(5Z)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]acetamide
Smiles: O=C(CN1C(=S)S/C(=C\c2cccs2)/C1=O)NCCc1c[nH]c2c1cccc2

STK589931
Synonyms: 7-chloro-1-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-(pyridin-3-ylmethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cc(ccc1O)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK851237
Synonyms: 5,6-dimethyl-3-phenyl-7-(4-phenylpiperazin-1-yl)pyrazolo[1,5-a]pyrimidine
Smiles: Cc1nc2n(c(c1C)N1CCN(CC1)c1ccccc1)ncc2c1ccccc1

STK589938
Synonyms: ethyl2,4-diamino-1,5-dicyano-3-thia-9-azaspiro[5.5]undeca-1,4-diene-9-carboxylate
Smiles: CCOC(=O)N1CCC2(CC1)C(=C(N)SC(=C2C#N)N)C#N

STK589940
Synonyms: 1-(4-hydroxy-3-methoxyphenyl)-2-(3-methoxypropyl)-5,7-dimethyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COCCCN1C(=O)c2c(C1c1ccc(c(c1)OC)O)c(=O)c1c(o2)c(C)cc(c1)C

STK589943
Synonyms: 4,7-dimethoxy-N'-[(E)-(2-methoxyphenyl)methylidene]-1H-indole-2-carbohydrazide
Smiles: COc1ccccc1/C=N/NC(=O)c1[nH]c2c(c1)c(OC)ccc2OC

STK851238
Synonyms: N-[(2Z)-4-phenyl-1,3-thiazol-2(3H)-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Smiles: O=C(C1COc2c(O1)cccc2)/N=c/1\scc([nH]1)c1ccccc1

STK589945
Synonyms: {[3-cyano-6-methyl-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-1,6-naphthyridin-2-yl]sulfanyl}(phenyl)aceticacid
Smiles: N#Cc1c(SC(c2ccccc2)C(=O)O)nc2c(c1c1cccs1)CN(CC2)C

STK589949
Synonyms: 8-amino-6-hydroxy-3-methyl-7-(2-methylprop-2-en-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: CC(=C)Cn1c(N)nc2c1c(O)nc(=O)n2C

STK589953
Synonyms: 7-[(4-bromobenzyl)oxy]-3-(4-chlorophenyl)-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: Clc1ccc(cc1)c1c(=O)c2ccc(cc2oc1C(F)(F)F)OCc1ccc(cc1)Br

STK851240
Synonyms: 7-(3-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-ylfuran-2-carboxylate
Smiles: COc1cccc(c1)c1cc(OC(=O)c2ccco2)cc2c1oc(=O)s2

STK851241
Synonyms: 2-[(2,4-dimethylphenyl)amino]-4-(2-methoxyphenyl)-8-methyl-4,9-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Smiles: COc1ccccc1C1N=C(Nc2ccc(cc2C)C)N=c2n1c(=O)cc([nH]2)C

STK589954
Synonyms: 5-[(2,6-dichlorobenzyl)oxy]-2-[5-(4-methoxyphenyl)pyrimidin-4-yl]phenol
Smiles: COc1ccc(cc1)c1cncnc1c1ccc(cc1O)OCc1c(Cl)cccc1Cl

STK589955
Synonyms: (5E)-6-hydroxy-3-(2-methoxyphenyl)-5-[(morpholin-4-ylamino)methylidene]pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccccc1N1C(=O)N=C(/C(=C\NN2CCOCC2)/C1=O)O

STK589958
Synonyms: N-[(2,2-diphenylethyl)carbamoyl]-L-alanine
Smiles: C[C@@H](C(=O)O)NC(=O)NCC(c1ccccc1)c1ccccc1

STK851242
Synonyms: N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(tetrahydrofuran-2-ylmethyl)pyridine-3-carboxamide
Smiles: O=C(N(Cc1cc2ccccc2[nH]c1=O)CC1CCCO1)c1cccnc1

STK589965
Synonyms: 2,6-dihydroxy-5-[(2E)-3-(1H-indol-3-yl)prop-2-enoyl]-3-(2-phenylethyl)pyrimidin-4(3H)-one
Smiles: O=C(c1c(O)nc(n(c1=O)CCc1ccccc1)O)/C=C/c1c[nH]c2c1cccc2

STK851244
Synonyms: (2Z)-2-(furan-2-ylmethylidene)-7-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-ylmorpholine-4-carboxylate
Smiles: O=C(N1CCOCC1)Oc1ccc2c(c1C)O/C(=C\c1ccco1)/C2=O

STK851245
Synonyms: 3-(2-methoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-ol
Smiles: COc1ccccc1c1cnn2c1nc(C)cc2O

STK851246
Synonyms: 1-(3-methoxypropyl)-2-[(4-methylpiperidin-1-yl)carbonyl]pyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-4(1H)-one
Smiles: COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)N1CCC(CC1)C

STK589973
Synonyms: 2-methyl-3-phenyl-N-(2-phenylethyl)-5-(propan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: CC(c1cc(NCCc2ccccc2)n2c(n1)c(c1ccccc1)c(n2)C)C

STK589976
Synonyms: N-[2-methyl-5-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]-2-(piperidin-1-yl)acetamide
Smiles: O=C(Nc1cc(ccc1C)c1nnc2n1nc(C)c1c2cccc1)CN1CCCCC1

STK589977
Synonyms: N-cyclopentyl-2-(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamide
Smiles: COc1c(OC)ccc2c1oc(=O)c(c2C)CC(=O)NC1CCCC1

STK589979
Synonyms: N-(3-bromobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-3-methoxybenzamide
Smiles: COc1cccc(c1)C(=O)N(C1CCS(=O)(=O)C1)Cc1cccc(c1)Br

STK851247
Synonyms: (5Z)-5-(2-chlorobenzylidene)-3-[4-oxo-4-(pyrrolidin-1-yl)butyl]-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C\c2ccccc2Cl)/C(=O)N1CCCC(=O)N1CCCC1

STK589986
Synonyms: N-(furan-2-ylmethyl)-5,6-dimethylfuro[2,3-d]pyrimidin-4-amine
Smiles: Cc1oc2c(c1C)c(ncn2)NCc1ccco1

STK589987
Synonyms: N-(3-chloro-2-methylphenyl)-2-(3-hydroxy-2H-1,4-benzothiazin-2-yl)acetamide
Smiles: O=C(Nc1cccc(c1C)Cl)CC1Sc2ccccc2N=C1O

STK589988
Synonyms: 3-[(4-cyclohexyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-4-phenylquinolin-2-ol
Smiles: Oc1nc2ccccc2c(c1Sc1nnc(n1C1CCCCC1)c1ccccc1)c1ccccc1

STK851251
Synonyms: 2-methyl-9-(morpholin-4-yl)-3-phenyl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazoline
Smiles: Cc1nn2c(c1c1ccccc1)nc1c(c2N2CCOCC2)CCCC1

STK589991
Synonyms: 2-[2-amino-5-(4-chlorophenyl)pyrimidin-4-yl]-5-[(2,4-dichlorobenzyl)oxy]phenol
Smiles: Clc1ccc(cc1)c1cnc(nc1c1ccc(cc1O)OCc1ccc(cc1Cl)Cl)N

STK589995
Synonyms: 3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-(pyridin-2-yl)propanamide
Smiles: O=C(Nc1ccccn1)CCn1nnc2c(c1=O)cccc2

STK589996
Synonyms: 5-[(3,4-dichlorobenzyl)oxy]-2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]phenol
Smiles: COc1ccc(cc1)c1c(C)noc1c1ccc(cc1O)OCc1ccc(c(c1)Cl)Cl

STK851252
Synonyms: 2-ethyl-N-(4-phenyl-1,2,5-oxadiazol-3-yl)butanamide
Smiles: CCC(C(=O)Nc1nonc1c1ccccc1)CC

STK851253
Synonyms: propan-2-yl5-[(dimethylcarbamoyl)oxy]-2-methyl-1-benzofuran-3-carboxylate
Smiles: CC(OC(=O)c1c(C)oc2c1cc(cc2)OC(=O)N(C)C)C

STK851254
Synonyms: 4-(4-fluorophenyl)-3-(2-hydroxyphenyl)-5-(tetrahydrofuran-2-ylmethyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: Fc1ccc(cc1)C1N(CC2CCCO2)C(=O)c2c1c([nH]n2)c1ccccc1O

STK589998
Synonyms: N-(3,4-dimethylphenyl)-5-(2-hydroxy-4,5-dimethylphenyl)-1H-pyrazole-3-carboxamide
Smiles: O=C(c1n[nH]c(c1)c1cc(C)c(cc1O)C)Nc1ccc(c(c1)C)C

STK851255
Synonyms: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(4-methoxybenzyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1)Cc1n[nH]c(=S)n1c1ccc2c(c1)OCCO2

STK590000
Synonyms: 2-{[4-amino-5-(5-phenyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(5-chloro-2-methylphenyl)acetamide
Smiles: O=C(Nc1cc(Cl)ccc1C)CSc1nnc(n1N)c1n[nH]c(c1)c1ccccc1

STK590001
Synonyms: 4-({[(5Z)-5-benzylidene-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetyl}amino)-2-hydroxybenzoicacid
Smiles: O=C(CN1C(=S)S/C(=C\c2ccccc2)/C1=O)Nc1ccc(c(c1)O)C(=O)O

STK590006
Synonyms: (5E)-2-(2-chlorophenyl)-5-(4-methoxybenzylidene)-3-(1,3-thiazol-2-yl)-3,5-dihydro-4H-imidazol-4-one
Smiles: COc1ccc(cc1)/C=C\1/N=C(N(C1=O)c1nccs1)c1ccccc1Cl

STK851258
Synonyms: 5-tert-butyl-3-phenyl-N-(tetrahydrofuran-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: CC(c1cc(NCC2CCCO2)n2c(n1)c(cn2)c1ccccc1)(C)C

STK590007
Synonyms: 10,11-dimethylbenzo[g]thieno[2',3':4,5]pyrimido[2,1-a]isoindol-9(7H)-one
Smiles: Cc1c(C)sc2c1c(=O)n1c(n2)c2c(C1)ccc1c2cccc1

STK851259
Synonyms: 1-oxo-N-(1,3-thiazol-2-yl)-1H-isothiochromene-3-carboxamide
Smiles: O=C(c1cc2ccccc2c(=O)s1)Nc1nccs1

STK590009
Synonyms: N-[3-(1H-indol-3-yl)propanoyl]threonine
Smiles: O=C(NC(C(=O)O)C(O)C)CCc1c[nH]c2c1cccc2

STK590010
Synonyms: 1-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-3H-benzo[f]chromen-3-one
Smiles: O=c1cc(CN2CCC3(CC2)OCCO3)c2c(o1)ccc1c2cccc1

STK851261
Synonyms: 6-ethyl-2,5-dimethyl-3-phenyl-N-(2-phenylethyl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: CCc1c(C)nc2n(c1NCCc1ccccc1)nc(c2c1ccccc1)C

STK590014
Synonyms: 4-methoxy-N-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-indole-2-carboxamide
Smiles: COc1cccc2c1cc([nH]2)C(=O)NC12CC3CC(C2)CC(C1)C3

STK851262
Synonyms: 2-{[(2Z)-4,7-dimethylquinazolin-2(1H)-ylidene]amino}-6-methylpyrimidin-4-ol
Smiles: Cc1cc(O)nc(n1)/N=c/1\nc(C)c2c([nH]1)cc(cc2)C

STK590015
Synonyms: 2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(6-methylpyridin-2-yl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1cccc(n1)C

STK590017
Synonyms: 2-(2-{[5-tert-butyl-3-(4-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino}ethoxy)ethanol
Smiles: OCCOCCNc1cc(nc2n1ncc2c1ccc(cc1)Cl)C(C)(C)C

STK590018
Synonyms: 2-(1,7,7-trimethylbicyclo[2.2.1]hept-2-yl)phenol
Smiles: Oc1ccccc1C1CC2C(C1(C)CC2)(C)C

STK590020
Synonyms: 4-{5-[(Z)-(2,6-dihydroxy-4-oxopyrimidin-5(4H)-ylidene)methyl]furan-2-yl}benzenesulfonamide
Smiles: OC1=NC(=O)/C(=C\c2ccc(o2)c2ccc(cc2)S(=O)(=O)N)/C(=N1)O

STK851264
Synonyms: 5-(2-chloro-6-fluorobenzyl)-N-(3-hydroxypropyl)-1,3,4-oxadiazole-2-carboxamide
Smiles: OCCCNC(=O)c1nnc(o1)Cc1c(F)cccc1Cl

STK851268
Synonyms: N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(2-methylpropyl)acetamide
Smiles: CC(CN(C(=O)C)Cc1cc2ccc(cc2[nH]c1=O)C)C

STK590031
Synonyms: 2-{[2-(4-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-N-phenylacetamide
Smiles: COc1ccc(cc1)c1nc(SCC(=O)Nc2ccccc2)c2c(n1)CC(OC2)(C)C

STK590032
Synonyms: 3-[(4-bromobenzyl)sulfanyl]-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-4-amine
Smiles: Brc1ccc(cc1)CSc1nnc(n1N)c1[nH]nc2c1CCC2

STK851270
Synonyms: 3-(quinolin-6-ylamino)-2-benzofuran-1(3H)-one
Smiles: O=C1OC(c2c1cccc2)Nc1ccc2c(c1)cccn2

STK851272
Synonyms: 5-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2-fluorophenyl)-3-(2-hydroxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COc1ccc(cc1OC)CCN1C(=O)c2c(C1c1ccccc1F)c([nH]n2)c1ccccc1O

STK851273
Synonyms: 2-methyl-3-phenyl-N-(1-phenylethyl)-6,7-dihydro-5H-cyclopenta[d]pyrazolo[1,5-a]pyrimidin-8-amine
Smiles: CC(c1ccccc1)Nc1c2CCCc2nc2n1nc(c2c1ccccc1)C

STK590043
Synonyms: 1-benzyl2-(8-chloro-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)(2S)-pyrrolidine-1,2-dicarboxylate
Smiles: O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)Oc1cc2oc(=O)c3c(c2cc1Cl)CCC3

STK590048
Synonyms: 3-(5-chloro-2-hydroxy-4-methylphenyl)-5-(2-hydroxyethyl)-4-[3-methoxy-4-(3-methylbutoxy)phenyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: OCCN1C(=O)c2c(C1c1ccc(c(c1)OC)OCCC(C)C)c([nH]n2)c1cc(Cl)c(cc1O)C

STK590050
Synonyms: 7-chloro-1-(4-ethylphenyl)-6-methyl-2-(pyridin-3-ylmethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCc1ccc(cc1)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK590052
Synonyms: (2S)-({N-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]-L-phenylalanyl}amino)(phenyl)ethanoicacid
Smiles: OC1=Nc2ccccc2N(C1)C(=O)N[C@H](C(=O)N[C@@H](c1ccccc1)C(=O)O)Cc1ccccc1

STK851277
Synonyms: 4-oxo-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-4H-chromene-2-carboxamide
Smiles: O=C(c1cc(=O)c2c(o1)cccc2)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1

STK851278
Synonyms: ethyl7-(3,4-dimethoxyphenyl)-2-methyl-5-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(N=c2n(C1c1ccc(c(c1)OC)OC)nc([nH]2)C)c1ccccc1

STK590053
Synonyms: (E)-1-(2-methoxyphenyl)-N-(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-ylmethoxy)methanimine
Smiles: COc1ccccc1/C=N/OCc1nn2c(n1)c1c(nc2)sc2c1CCCC2

STK590056
Synonyms: 1-[4-(propan-2-yl)phenyl]-2-(pyridin-4-ylmethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: O=C1N(Cc2ccncc2)C(c2c1oc1ccccc1c2=O)c1ccc(cc1)C(C)C

STK590057
Synonyms: 8-hydrazinyl-5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinoline
Smiles: CCCc1nc2oc3c(c2c2c1CCCC2)ncnc3NN

STK590058
Synonyms: N-(3-chloro-4-methoxyphenyl)-5-(2-hydroxy-5-methylphenyl)-1H-pyrazole-3-carboxamide
Smiles: COc1ccc(cc1Cl)NC(=O)c1n[nH]c(c1)c1cc(C)ccc1O

STK590061
Synonyms: 4-chloro-5-[(2E)-2-(2,4-dimethoxybenzylidene)hydrazinyl]pyridazin-3-ol
Smiles: COc1cc(OC)ccc1/C=N/Nc1cnnc(c1Cl)O

STK851279
Synonyms: {[3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}acetonitrile
Smiles: N#CCOc1ccc2c(c1)occ(c2=O)c1ccc(c(c1)OC)OC

STK590064
Synonyms: N-(2,5-dimethylphenyl)-5-(2-hydroxy-4,5-dimethylphenyl)-1H-pyrazole-3-carboxamide
Smiles: Cc1ccc(c(c1)NC(=O)c1n[nH]c(c1)c1cc(C)c(cc1O)C)C

STK590065
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NC(=O)NCc1ccccc1OC)C

STK851280
Synonyms: 2-methyl-N-(3-methylphenyl)-3-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrazolo[1,5-a]pyrimidin-8-amine
Smiles: Cc1cccc(c1)Nc1c2CCCc2nc2n1nc(c2c1ccccc1)C

STK851281
Synonyms: 2-methyl-8-(morpholin-4-yl)-3-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrazolo[1,5-a]pyrimidine
Smiles: Cc1nn2c(c1c1ccccc1)nc1c(c2N2CCOCC2)CCC1

STK590071
Synonyms: 2-(4-chlorophenyl)-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]pyrimidine
Smiles: Clc1ccc(cc1)c1nn2c(n1)c1c(nc2)Oc2c(C1c1ccco1)c(C)nn2c1ccccc1

STK590076
Synonyms: N-[(4-sulfamoylbenzyl)carbamoyl]-L-methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)NCc1ccc(cc1)S(=O)(=O)N

STK590077
Synonyms: 8-(3,5-dimethyl-1H-pyrazol-1-yl)-6-hydroxy-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: Cc1cccc(c1)OCC(Cn1c2c(O)nc(=O)n(c2nc1n1nc(cc1C)C)C)O

STK590081
Synonyms: N-(1,3-benzodioxol-5-ylcarbamoyl)-L-valine
Smiles: O=C(N[C@H](C(=O)O)C(C)C)Nc1ccc2c(c1)OCO2

STK851282
Synonyms: 2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]-5-[(2-methylprop-2-en-1-yl)oxy]phenol
Smiles: COc1ccc(cc1)c1c(C)noc1c1ccc(cc1O)OCC(=C)C

STK590084
Synonyms: [(4-chlorophenyl)(3-hydroxy-5-methyl-1H-pyrazol-4-yl)methyl]propanedinitrile
Smiles: N#CC(C(c1c(C)[nH]nc1O)c1ccc(cc1)Cl)C#N

STK851283
Synonyms: N-[4-(3,4-dimethoxyphenyl)-1,2,5-oxadiazol-3-yl]-2-(2-fluorophenoxy)butanamide
Smiles: CCC(C(=O)Nc1nonc1c1ccc(c(c1)OC)OC)Oc1ccccc1F

STK851284
Synonyms: 1-benzyl-2-[(2-ethylpiperidin-1-yl)carbonyl]-7-methylpyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-4(1H)-one
Smiles: CCC1CCCCN1C(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cc(cc1)C

STK590090
Synonyms: 9-(4-hydroxyphenyl)-2-(prop-2-en-1-ylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: C=CCSc1nn2c(n1)N=C1C(=C(O)CCC1)C2c1ccc(cc1)O

STK590091
Synonyms: 5-tert-butyl-3-(4-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-ol
Smiles: Clc1ccc(cc1)c1cnn2c1nc(cc2O)C(C)(C)C

STK590094
Synonyms: 2-({6-cyano-8,8-dimethyl-5-[(4-methylphenyl)amino]-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetamide
Smiles: N#Cc1c2CC(C)(C)OCc2c2n(c1Nc1ccc(cc1)C)c(SCC(=O)N)nn2

STK851288
Synonyms: 4-oxo-3-phenyl-2-(trifluoromethyl)-4H-chromen-7-yldiethylcarbamate
Smiles: CCN(C(=O)Oc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C(F)(F)F)CC

STK590096
Synonyms: 4-({(1E)-1-[4-hydroxy-2,6-dioxo-1-(prop-2-en-1-yl)-1,6-dihydropyrimidin-5(2H)-ylidene]propyl}amino)benzoicacid
Smiles: C=CCN1C(=O)N=C(/C(=C(\Nc2ccc(cc2)C(=O)O)/CC)/C1=O)O

STK590099
Synonyms: 7-chloro-1-[3-methoxy-4-(2-methylpropoxy)phenyl]-6-methyl-2-(pyridin-3-ylmethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cc(ccc1OCC(C)C)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK590103
Synonyms: 4-oxo-N-(pyridin-4-ylmethyl)-4H-chromene-2-carboxamide
Smiles: O=C(c1cc(=O)c2c(o1)cccc2)NCc1ccncc1

STK590105
Synonyms: trans-4-{[(N-{[(3S)-2-(tert-butoxycarbonyl)-1,2,3,4-tetrahydroisoquinolin-3-yl]carbonyl}-L-leucyl)amino]methyl}cyclohexanecarboxylicacid
Smiles: CC(C[C@@H](C(=O)NC[C@@H]1CC[C@H](CC1)C(=O)O)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)C

STK590110
Synonyms: (E)-1-(4-methoxyphenyl)-N-[(9-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]methanimine
Smiles: COc1ccc(cc1)/C=N/OCc1nn2c(n1)c1c(nc2)sc2c1CCC(C2)C

STK590112
Synonyms: 2-(7,8-dihydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[2-(3-fluorophenyl)ethyl]acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2O)O)NCCc1cccc(c1)F

STK590115
Synonyms: N~5~-(4-methoxyphenyl)-7-methyl-6,7,8,9-tetrahydro-3H-pyrazolo[3,4-c][2,7]naphthyridine-1,5-diamine
Smiles: COc1ccc(cc1)Nc1nc2[nH]nc(c2c2c1CN(C)CC2)N

STK851292
Synonyms: ethyl(2E)-2-{[(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]imino}-4-methyl-2,3-dihydro-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1s/c(=N/C(=O)/C=C/c2ccc(c(c2)OC)OC)/[nH]c1C

STK590120
Synonyms: 8-(4-benzylpiperazin-1-yl)-6-hydroxy-7-[2-(4-methoxyphenyl)ethyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: COc1ccc(cc1)CCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1ccccc1

STK590133
Synonyms: (2Z)-6-[(3-chlorobenzyl)oxy]-2-(4-nitrobenzylidene)-1-benzofuran-3(2H)-one
Smiles: Clc1cccc(c1)COc1ccc2c(c1)O/C(=C\c1ccc(cc1)[N+](=O)[O-])/C2=O

STK590135
Synonyms: (2Z)-7-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-3-oxo-2-(thiophen-2-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1cccs1)/C2=O

STK590141
Synonyms: 8-{[2-(trifluoromethyl)phenyl]sulfonyl}-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Smiles: O=S(=O)(c1ccccc1C(F)(F)F)N1CCc2c(C1)cc1c(c2)OCCCO1

STK590143
Synonyms: 2-(3,4-diethoxyphenyl)-4-imino-9,10-dimethoxy-6,7-dihydro-4H-pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: CCOc1cc(ccc1OCC)c1cc2c3cc(OC)c(cc3CCn2c(=N)c1C#N)OC

STK590146
Synonyms: 7-(4-methoxyphenyl)-5,6-dimethyl-N-(1,3-thiazol-2-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Smiles: COc1ccc(cc1)n1c2ncnc(c2c(c1C)C)Nc1nccs1

STK590153
Synonyms: 5-(2-hydroxy-4,5-dimethylphenyl)-N-{4-[(2-methylpiperidin-1-yl)sulfonyl]phenyl}-1H-pyrazole-3-carboxamide
Smiles: CC1CCCCN1S(=O)(=O)c1ccc(cc1)NC(=O)c1n[nH]c(c1)c1cc(C)c(cc1O)C

STK590154
Synonyms: N-[(4-chlorobenzyl)carbamoyl]-L-leucine
Smiles: CC(C[C@@H](C(=O)O)NC(=O)NCc1ccc(cc1)Cl)C

STK590156
Synonyms: methylN-[(2-methylphenyl)carbamoyl]-L-leucinate
Smiles: COC(=O)[C@@H](NC(=O)Nc1ccccc1C)CC(C)C

STK851294
Synonyms: 1-(3-methoxypropyl)-9-methyl-4-oxo-N-[4-(propan-2-yl)phenyl]-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)Nc1ccc(cc1)C(C)C

STK590160
Synonyms: (4-hydroxy-3,6,6-trimethyl-4,5,6,7-tetrahydro-1-benzofuran-2-yl)(morpholin-4-yl)methanone
Smiles: O=C(c1oc2c(c1C)C(O)CC(C2)(C)C)N1CCOCC1

STK590161
Synonyms: N-[5-hydroxy-2-(phenoxymethyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]benzamide
Smiles: Oc1cc(NC(=O)c2ccccc2)n2c(n1)nc(n2)COc1ccccc1

STK590162
Synonyms: N-(2,5-dimethoxybenzyl)-5-fluoro-N-[2-(morpholin-4-yl)ethyl]-1H-indole-2-carboxamide
Smiles: COc1ccc(cc1CN(C(=O)c1cc2c([nH]1)ccc(c2)F)CCN1CCOCC1)OC

STK590166
Synonyms: 4-(4-methoxyphenyl)-N-{4-[(4-methoxyphenyl)carbamoyl]phenyl}tetrahydro-2H-pyran-4-carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1ccc(cc1)NC(=O)C1(CCOCC1)c1ccc(cc1)OC

STK590167
Synonyms: (2E)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-ethylbenzyl)-3-phenylprop-2-enamide
Smiles: CCc1ccc(cc1)CN(C1CCS(=O)(=O)C1)C(=O)/C=C/c1ccccc1

STK851296
Synonyms: 2-[2-amino-5-(3-methoxyphenoxy)pyrimidin-4-yl]-5-[(4-fluorobenzyl)oxy]phenol
Smiles: COc1cccc(c1)Oc1cnc(nc1c1ccc(cc1O)OCc1ccc(cc1)F)N

STK590168
Synonyms: 6-hydroxy-1',6'-dimethyl-3-(propan-2-yl)-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4(3H)-dione
Smiles: Cc1ccc2c(c1)CC1(CN2C)C(=NC(=O)N(C1=O)C(C)C)O

STK590169
Synonyms: 2-methyl-3-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrazolo[1,5-a]pyrimidine-8-thiol
Smiles: Cc1nn2c(c1c1ccccc1)nc1c(c2S)CCC1

STK590177
Synonyms: ethyl2-[(4,7-dimethyl-1,2-dihydroquinazolin-2-yl)amino]-4-methylpyrimidine-5-carboxylate
Smiles: CCOC(=O)c1cnc(nc1C)NC1Nc2cc(C)ccc2C(=N1)C

STK590178
Synonyms: (5Z)-5-[(2E)-3-(3,4-dimethoxyphenyl)-1-hydroxyprop-2-en-1-ylidene]-6-hydroxy-3-(3-methoxypropyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COCCCN1C(=O)N=C(/C(=C(\C=C\c2ccc(c(c2)OC)OC)/O)/C1=O)O

STK590181
Synonyms: 2'-(1,3-benzothiazol-2-ylamino)-7',8'-dihydro-6'H-spiro[cyclohexane-1,4'-quinazolin]-5'-ol
Smiles: OC1=C2C(=NC(=NC32CCCCC3)Nc2nc3c(s2)cccc3)CCC1

STK590183
Synonyms: (4E)-2-(4-chlorophenyl)-4-{[(2-hydroxyethyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: OCCN/C=C\1/C(=O)N(c2ccc(cc2)Cl)C(=O)c2c1cccc2

STK590186
Synonyms: 7-hydroxy-5-(3-methoxyphenyl)-2-methyl-5,6-dihydropyrido[2,3-d]pyrimidin-4(3H)-one
Smiles: COc1cccc(c1)C1CC(=Nc2c1c(=O)[nH]c(n2)C)O

STK590189
Synonyms: (3E)-4-imino-8-(methylsulfonyl)-3-(1H-pyrrol-2-ylmethylidene)-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-2-one
Smiles: O=C1N=c2sc3c(n2C(=N)/C/1=C\c1ccc[nH]1)ccc(c3)S(=O)(=O)C

STK851297
Synonyms: 6-chloro-N-[(2Z)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxo-4H-chromene-2-carboxamide
Smiles: Clc1ccc2c(c1)c(=O)cc(o2)C(=O)/N=c\1/[nH]nc(s1)C

STK851298
Synonyms: 1-benzyl-N-(4-methoxyphenyl)-9-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1C

STK851300
Synonyms: N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-7-methyl-4-oxo-4H-chromene-2-carboxamide
Smiles: Cc1ccc2c(c1)oc(cc2=O)C(=O)Nc1sc2c(c1C(=O)N)CCCC2

STK590192
Synonyms: 3-(furan-2-ylmethyl)-4-imino-5-(2-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol
Smiles: COc1ccccc1C1c2ccc(cc2Oc2c1c(=N)n(cn2)Cc1ccco1)O

STK590193
Synonyms: 1,7-dimethyl-8-(2-phenylethyl)-3-[2-(piperidin-1-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cc1cn2c(n1CCc1ccccc1)nc1c2c(=O)n(c(=O)n1C)CCN1CCCCC1

STK590194
Synonyms: N-(5-hydroxy[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-4-nitrobenzamide
Smiles: Oc1cc(NC(=O)c2ccc(cc2)[N+](=O)[O-])n2c(n1)ncn2

STK851302
Synonyms: furan-2-yl{4-[(1-methyl-5-nitro-1H-benzimidazol-2-yl)methyl]piperazin-1-yl}methanone
Smiles: [O-][N+](=O)c1ccc2c(c1)nc(n2C)CN1CCN(CC1)C(=O)c1ccco1

STK590196
Synonyms: N-(5-methyl-7-phenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)pyridine-3-carboxamide
Smiles: CC1Nc2nc(nn2C(C1)c1ccccc1)NC(=O)c1cccnc1

STK590199
Synonyms: 1,7-dimethyl-4-oxo-N-[4-(propan-2-yl)phenyl]-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: Cc1ccc2n(c1)c(=O)c1c(n2)n(c(c1)C(=O)Nc1ccc(cc1)C(C)C)C

STK590202
Synonyms: 4-ethyl-9-(pyridin-2-ylmethyl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: CCc1cc(=O)oc2c1ccc1c2CN(CO1)Cc1ccccn1

STK590206
Synonyms: 2-[(6-chloro-2-oxo-4-propyl-2H-chromen-7-yl)oxy]-N-[3-(morpholin-4-yl)propyl]propanamide
Smiles: CCCc1cc(=O)oc2c1cc(Cl)c(c2)OC(C(=O)NCCCN1CCOCC1)C

STK590208
Synonyms: 3-(4-fluorophenyl)-11-methyl-3,4-dihydro-2H-dibenzo[b,e][1,4]diazepin-1-ol
Smiles: Fc1ccc(cc1)C1CC(=C2C(=Nc3ccccc3N=C2C)C1)O

STK590209
Synonyms: 5-(benzyloxy)-2-[4-(4-chlorophenyl)-3-methyl-1,2-oxazol-5-yl]phenol
Smiles: Clc1ccc(cc1)c1c(C)noc1c1ccc(cc1O)OCc1ccccc1

STK590210
Synonyms: N-(2-methoxyethyl)-4-(2-methylpropyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-7-amine
Smiles: COCCNc1ncnc2c1oc1c2c2CCCc2c(n1)CC(C)C

STK851303
Synonyms: 2-methoxyethyl1,2-dimethyl-5-[(thiophen-2-ylcarbonyl)oxy]-1H-indole-3-carboxylate
Smiles: COCCOC(=O)c1c(C)n(c2c1cc(cc2)OC(=O)c1cccs1)C

STK590211
Synonyms: 8,8-dimethyl-4-(4-methylpiperazin-1-yl)-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
Smiles: CN1CCN(CC1)c1ncnc2c1oc1c2cc2c(n1)CC(OC2)(C)C

STK851305
Synonyms: 1-(3-methoxypropyl)-9-methyl-2-[(3-methylpiperidin-1-yl)carbonyl]pyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-4(1H)-one
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)N1CCCC(C1)C

STK590213
Synonyms: 4-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-[2-(4-fluorophenyl)ethyl]benzamide
Smiles: Fc1ccc(cc1)CCNC(=O)c1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK851306
Synonyms: N-[(2Z)-4-(4-methylphenyl)-1,3-thiazol-2(3H)-ylidene]-2-(2-oxo-1,3-benzoxazol-3(2H)-yl)acetamide
Smiles: Cc1ccc(cc1)c1cs/c(=N\C(=O)Cn2c(=O)oc3c2cccc3)/[nH]1

STK590216
Synonyms: N-[5-oxo-2-(trifluoromethyl)-4,5-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]benzamide
Smiles: O=C(c1ccccc1)Nc1cc(=O)[nH]c2n1nc(n2)C(F)(F)F

STK590219
Synonyms: methyl4-{[7-(benzyloxy)-2-methyl-4-oxo-4H-chromen-3-yl]oxy}benzoate
Smiles: COC(=O)c1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2)OCc1ccccc1

STK590221
Synonyms: ethyl4-(6-chloro-2-hydroxy-4-phenylquinolin-3-yl)piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1c(O)nc2c(c1c1ccccc1)cc(cc2)Cl

STK590223
Synonyms: N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]furan-2-carboxamide
Smiles: Cc1ccc(cc1)c1c(NC(=O)c2ccco2)oc2c(c1=O)cccc2

STK851308
Synonyms: 4-(3-methylphenoxy)-N-[(2Z)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Smiles: Cc1cccc(c1)OCCCC(=O)/N=c\1/[nH]nc(s1)C

STK590224
Synonyms: 3-(1H-benzimidazol-1-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]propan-1-one
Smiles: Fc1ccc(cc1)N1CCN(CC1)C(=O)CCn1cnc2c1cccc2

STK590228
Synonyms: 1-[10-(furan-2-yl)-8-methyl-2-(pyridin-4-yl)-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone
Smiles: CC(=O)C1=C(C)Oc2c(C1c1ccco1)c1nc(nn1cn2)c1ccncc1

STK590231
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)-3-(2-chlorophenyl)-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)c1ccccc1Cl

STK590232
Synonyms: 5-[(2,5-dimethylbenzyl)oxy]-2-(5-phenylpyrimidin-4-yl)phenol
Smiles: Cc1ccc(c(c1)COc1ccc(c(c1)O)c1ncncc1c1ccccc1)C

STK590234
Synonyms: 4'-amino-9',10'-dimethoxy-7-oxo-2,3,6,6',7,7'-hexahydrospiro[1,4-dioxino[2,3-f]indole-8,2'-pyrido[2,1-a]isoquinoline]-3'-carbonitrile
Smiles: N#CC1=C(N)N2CCc3c(C2=CC21C(=O)Nc1c2cc2OCCOc2c1)cc(c(c3)OC)OC

STK590239
Synonyms: 1-{4-[(4-chlorobenzyl)oxy]phenyl}-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(cc1)OCc1ccc(cc1)Cl)c(=O)c1c(o2)cccc1

STK590244
Synonyms: 7-propyl-14H-chromeno[2',3':4,5]pyrimido[1,6-a]benzimidazol-14-one
Smiles: CCCc1nc2oc3ccccc3c(=O)c2c2n1c1ccccc1n2

STK851311
Synonyms: 3-(2-methoxyphenyl)-5-methyl-N-(2-phenylethyl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: COc1ccccc1c1cnn2c1nc(C)cc2NCCc1ccccc1

STK590247
Synonyms: N-[(3,5-dimethylpiperidin-1-yl)carbonyl]-L-valine
Smiles: CC1CC(C)CN(C1)C(=O)N[C@H](C(=O)O)C(C)C

STK851312
Synonyms: N-[4-cyano-2-hydroxy-5-methyl-3-(trifluoromethyl)-3H-pyrrol-3-yl]-3-methoxybenzamide
Smiles: N#CC1=C(C)N=C(C1(NC(=O)c1cccc(c1)OC)C(F)(F)F)O

STK590249
Synonyms: N-[(2Z)-5,5-dioxido-3-phenyltetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]cyclopropanecarboxamide
Smiles: O=C(C1CC1)/N=C/1\SC2C(N1c1ccccc1)CS(=O)(=O)C2

STK851313
Synonyms: 1-benzyl-2-[(2-ethylpiperidin-1-yl)carbonyl]-9-methylpyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-4(1H)-one
Smiles: CCC1CCCCN1C(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1C

STK590254
Synonyms: N-({4-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]phenyl}carbonyl)-L-valine
Smiles: O=C(c1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)N[C@H](C(=O)O)C(C)C

STK590255
Synonyms: 7-[4-(2-methylprop-2-en-1-yl)piperazin-1-yl]-3-phenyl-5-(propan-2-yl)pyrazolo[1,5-a]pyrimidine
Smiles: CC(c1cc(N2CCN(CC2)CC(=C)C)n2c(n1)c(cn2)c1ccccc1)C

STK590258
Synonyms: N,N-diethyl-N'-(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)ethane-1,2-diamine
Smiles: CCN(CCNc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C)CC

STK590259
Synonyms: N-(3-methyl-1-phenyl-1H-pyrazol-5-yl)-1-phenyl-1H-tetrazol-5-amine
Smiles: Cc1cc(n(n1)c1ccccc1)Nc1nnnn1c1ccccc1

STK851315
Synonyms: 2-methoxyethyl5-{[(4-methoxyphenyl)sulfonyl]oxy}-2-methyl-1-benzofuran-3-carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(cc2)OS(=O)(=O)c1ccc(cc1)OC

STK590262
Synonyms: 2-hydroxy-7-methoxy-3-{[(E)-(2,4,6-trimethylcyclohex-3-en-1-yl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)[nH]c1c2nc(n(c1=O)/N=C/C1C(C)CC(=CC1C)C)O

STK851317
Synonyms: 1-(3-methylphenyl)-N-(4-methylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide
Smiles: Cc1ccc(cc1)NC(=O)c1nn(ccc1=O)c1cccc(c1)C

STK590268
Synonyms: N~2~-[(4-methylphenyl)sulfonyl]-N-[3-(1H-tetrazol-1-yl)phenyl]methioninamide
Smiles: CSCCC(C(=O)Nc1cccc(c1)n1cnnn1)NS(=O)(=O)c1ccc(cc1)C

STK851318
Synonyms: 2-[2-amino-5-(3,4-dimethoxyphenyl)pyrimidin-4-yl]-5-[(4-chlorobenzyl)oxy]phenol
Smiles: COc1cc(ccc1OC)c1cnc(nc1c1ccc(cc1O)OCc1ccc(cc1)Cl)N

STK590269
Synonyms: (5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-(3-ethoxy-4-propoxybenzylidene)-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: CCCOc1ccc(cc1OCC)/C=C/1\C(=O)N(C2CCS(=O)(=O)C2)C(=O)C(=C1C)C#N

STK590270
Synonyms: 2-[4-(3,4-dimethoxyphenyl)-1H-pyrazol-3-yl]-5-[(2,5-dimethylbenzyl)oxy]phenol
Smiles: COc1cc(ccc1OC)c1c[nH]nc1c1ccc(cc1O)OCc1cc(C)ccc1C

STK590275
Synonyms: 2-[(2,6-dichlorobenzyl)amino]-5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: Clc1cccc(c1CNc1nc2n(n1)c(O)c(c(n2)C)C)Cl

STK590279
Synonyms: 2,2-dimethyl-N-(2-methylphenyl)tetrahydro-2H-pyran-4-carboxamide
Smiles: O=C(C1CCOC(C1)(C)C)Nc1ccccc1C

STK590282
Synonyms: 3-(4-chlorophenyl)-1-[2-(dimethylamino)ethyl]-7-ethyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Smiles: CCN1CCc2c(C1)sc1c2c(=O)n(c(=O)n1CCN(C)C)c1ccc(cc1)Cl

STK851319
Synonyms: 2-ethyl-10-methyl-3-propylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: CCCn1c(CC)nc2c(c1=O)c(=O)c1c(n2C)cccc1

STK590288
Synonyms: (3aR,6aS)-5-cyclohexyl-3-(3,4-dimethoxyphenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: COc1cc(ccc1OC)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)C1CCCCC1

STK590289
Synonyms: N-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)-L-leucine
Smiles: CC(C[C@@H](C(=O)O)NC(=O)NC1CCCc2c1cccc2)C

STK590290
Synonyms: 3-[(3-hydroxyquinoxalin-2-yl)(phenyl)methyl]pentane-2,4-dione
Smiles: CC(=O)C(C(c1nc2ccccc2nc1O)c1ccccc1)C(=O)C

STK590291
Synonyms: (4E)-2-(4-chlorophenyl)-4-({[3-(morpholin-4-yl)propyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)/C(=C/NCCCN2CCOCC2)/c2c(C1=O)cccc2

STK590292
Synonyms: 1-(4-methylphenyl)-4-(4-nitrophenyl)-4,7-dihydrofuro[3,4-b]pyridine-2,5(1H,3H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)CC(C2=C1COC2=O)c1ccc(cc1)[N+](=O)[O-]

STK851321
Synonyms: 5-methyl-N-[2-(morpholin-4-yl)ethyl]-3-phenyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: Cc1cc(NCCN2CCOCC2)n2c(n1)c(c1ccccc1)c(n2)C(F)(F)F

STK590306
Synonyms: 5-[(3-{(5E)-5-[(2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}propanoyl)amino]-2-hydroxybenzoicacid
Smiles: O=C(Nc1ccc(c(c1)C(=O)O)O)CCN1C(=S)S/C(=C/C=C/c2ccco2)/C1=O

STK590307
Synonyms: 5-amino-3,4'-bipyridin-6(1H)-one
Smiles: O=c1[nH]cc(cc1N)c1ccncc1

STK590312
Synonyms: N-[5-(4-chlorophenyl)-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)Nn1cc2c(c1c1ccc(cc1)Cl)c(=O)n(c(=O)n2C)C

STK590314
Synonyms: N'-(5,6-diphenylfuro[2,3-d]pyrimidin-4-yl)-N,N-dimethylpropane-1,3-diamine
Smiles: CN(CCCNc1ncnc2c1c(c1ccccc1)c(o2)c1ccccc1)C

STK590317
Synonyms: 2-amino-4-(2,4-dimethoxyphenyl)-5-hydroxy-4H-pyrano[3,2-c]quinoline-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1OC)OC)c(O)nc1c2cccc1

STK590322
Synonyms: ethyl5-methyl-7-(3-nitrophenyl)-2-(trifluoromethyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1cccc(c1)[N+](=O)[O-])nc([nH]2)C(F)(F)F

STK590326
Synonyms: 6'-hydroxy-3',4-dimethyl-3,4-dihydro-1H,2'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4'(3'H)-dione
Smiles: O=C1N=C(O)C2(C(=O)N1C)CN(C)c1c(C2)c2ccccc2cc1

STK590327
Synonyms: 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-3-(5-chloro-2-hydroxy-4-methylphenyl)-5-(2-methoxyethyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COCCN1C(=O)c2c(C1c1cc(Br)c(c(c1)OC)O)c([nH]n2)c1cc(Cl)c(cc1O)C

STK590331
Synonyms: N-(2-methoxyethyl)-2-methyl-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]propanamide
Smiles: COCCN(C(=O)C(C)C)Cc1cc2cccc(c2[nH]c1=O)C

STK851326
Synonyms: ethyl5-acetyl-2-[(3-chloroquinoxalin-2-yl)amino]-4-methylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(Nc2nc3ccccc3nc2Cl)sc(c1C)C(=O)C

STK590339
Synonyms: 3-(4-chlorophenyl)-7-[4-(diphenylmethyl)piperazin-1-yl]-5-methylpyrazolo[1,5-a]pyrimidine
Smiles: Clc1ccc(cc1)c1cnn2c1nc(C)cc2N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK851328
Synonyms: 1-[5-(furan-2-yl)-1',3'-diphenyl-3,4-dihydro-1'H,2H-3,4'-bipyrazol-2-yl]ethanone
Smiles: CC(=O)N1N=C(CC1c1cn(nc1c1ccccc1)c1ccccc1)c1ccco1

STK851329
Synonyms: 2-(2-methylphenoxy)-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]acetamide
Smiles: O=C(Nc1onc(c1)c1ccc(cc1)C)COc1ccccc1C

STK590345
Synonyms: 1-({(4E)-6-amino-4-[(2-methoxyphenyl)imino]-4,5-dihydro-1,3,5-triazin-2-yl}methyl)piperidine-4-carboxamide
Smiles: COc1ccccc1/N=c\1/nc(CN2CCC(CC2)C(=O)N)nc([nH]1)N

STK590347
Synonyms: 2-amino-N-(6-methylheptan-2-yl)-1-(3,4,5-trimethoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1cc(cc(c1OC)OC)Cn1c(N)c(c2c1nc1ccccc1n2)C(=O)NC(CCCC(C)C)C

STK590354
Synonyms: 3-(5-chloro-2-hydroxy-4-methylphenyl)-4-(4-methoxyphenyl)-5-[2-(4-methoxyphenyl)ethyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COc1ccc(cc1)C1N(CCc2ccc(cc2)OC)C(=O)c2c1c([nH]n2)c1cc(Cl)c(cc1O)C

STK801765
Synonyms: 5-amino-1-(1-phenylpiperidin-4-yl)-1H-pyrazol-3-ol
Smiles: Oc1nn(c(c1)N)C1CCN(CC1)c1ccccc1

STK851331
Synonyms: 6-benzyl-2-[(2-chloro-6-fluorobenzyl)amino]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: Cc1nc2nc(nn2c(c1Cc1ccccc1)O)NCc1c(F)cccc1Cl

STK590357
Synonyms: N-[3-oxo-2-(trifluoromethyl)-2,3-dihydro-1H-imidazo[1,2-a]benzimidazol-2-yl]cyclopropanecarboxamide
Smiles: O=C(C1CC1)NC1(Nc2n(C1=O)c1c(n2)cccc1)C(F)(F)F

STK851333
Synonyms: 1-benzyl-7-methyl-N-(2-methylpropyl)-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: CC(CNC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cc(cc1)C)C

STK590362
Synonyms: (3aR,6aS)-3-(2-chlorophenyl)-5-(2,3-dimethylphenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: O=C1[C@H]2ON=C([C@H]2C(=O)N1c1cccc(c1C)C)c1ccccc1Cl

STK851335
Synonyms: methyl1-{[1-(3-methoxypropyl)-9-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-2-yl]carbonyl}piperidine-4-carboxylate
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)N1CCC(CC1)C(=O)OC

STK590368
Synonyms: N-{[4-(trifluoromethoxy)phenyl]carbamoyl}-L-leucine
Smiles: CC(C[C@@H](C(=O)O)NC(=O)Nc1ccc(cc1)OC(F)(F)F)C

STK590369
Synonyms: 2-[(4-chlorobenzyl)amino]-5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7(3H)-one
Smiles: Clc1ccc(cc1)CNc1[nH]c2n(n1)c(=O)c(c(n2)C)C

STK590373
Synonyms: 5-[5-(1,3-benzodioxol-5-yl)pyrazolidin-3-ylidene]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1N(C)C(=O)C(=C2NNC(C2)c2ccc3c(c2)OCO3)C(=O)N1C

STK851337
Synonyms: (2Z)-2-(4-ethylbenzylidene)-6-hydroxy-1-benzofuran-3(2H)-one
Smiles: CCc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)O

STK590374
Synonyms: 6-benzyl-2-[(4-methoxybenzyl)amino]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(3H)-one
Smiles: COc1ccc(cc1)CNc1nn2c([nH]1)nc(c(c2=O)Cc1ccccc1)C

STK851338
Synonyms: 2-methyl-1-phenyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: O=C1N(C)C(c2c1oc1ccccc1c2=O)c1ccccc1

STK851339
Synonyms: 2-methyl-3-phenyl-8-(pyrrolidin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrazolo[1,5-a]pyrimidine
Smiles: Cc1nn2c(c1c1ccccc1)nc1c(c2N2CCCC2)CCC1

STK590383
Synonyms: 1-[5-hydroxy-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]pyrrolidine-2,5-dione
Smiles: O=C1CCC(=O)N1c1cc(O)nc2n1nc(n2)c1cccnc1

STK590386
Synonyms: 9-(3-chlorophenyl)-6-methyl-2,3,9,10-tetrahydro-8H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(1H)-one
Smiles: Clc1cccc(c1)N1COc2c(C1)cc1c(c2C)oc(=O)c2c1CCC2

STK590390
Synonyms: 13,13-dimethyl-7-oxo-N-(pyridin-3-ylmethyl)-7,11b,12,13-tetrahydro-5H-isoindolo[2,1-b][2]benzazepine-8-carboxamide
Smiles: O=C(c1cccc2c1C(=O)N1C2CC(C)(C)c2c(C1)cccc2)NCc1cccnc1

STK590393
Synonyms: 2-{(E)-[1-(2-ethoxyphenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}-N-phenylhydrazinecarbothioamide
Smiles: CCOc1ccccc1N1C(=O)N=C(/C(=C\NNC(=S)Nc2ccccc2)/C1=O)O

STK590395
Synonyms: (2-methyl-1,1-dioxido-4-propoxy-2H-1,2-benzothiazin-3-yl)(morpholin-4-yl)methanone
Smiles: CCCOC1=C(C(=O)N2CCOCC2)N(C)S(=O)(=O)c2c1cccc2

STK590399
Synonyms: 6,8-dimethyl-2-[(4-methylpiperazin-1-yl)carbonyl]-4H-chromen-4-one
Smiles: CN1CCN(CC1)C(=O)c1cc(=O)c2c(o1)c(C)cc(c2)C

STK590405
Synonyms: 9-(3-chlorophenyl)-10-[(2-methoxyethyl)amino]-2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8(9H)-one
Smiles: COCCNc1nc2c3c(sc2c(=O)n1c1cccc(c1)Cl)nc(c1c3CC(C)(C)OC1)C

STK590407
Synonyms: 2-[(1R,4aS,8aS)-1-(4-fluorophenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-N-(furan-2-ylmethyl)acetamide
Smiles: O=C(CN1CC[C@@]2([C@H]([C@@H]1c1ccc(cc1)F)CCCC2)O)NCc1ccco1

STK590408
Synonyms:
Smiles: CCC([C@@H](C(=O)NC1CCCC1)NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)C

STK851345
Synonyms: 2-(4,6-dimethyl-1-benzofuran-3-yl)-N-(2-methylphenyl)acetamide
Smiles: O=C(Cc1coc2c1c(C)cc(c2)C)Nc1ccccc1C

STK590412
Synonyms: 7-methyl-8-(phenylsulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Smiles: CC1c2cc3OCCCOc3cc2CCN1S(=O)(=O)c1ccccc1

STK590414
Synonyms: 12-phenyl-2-(thiophen-2-yl)-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Smiles: O=C1CCCC2=C1C(c1ccccc1)c1c(O2)ncn2c1nc(n2)c1cccs1

STK590415
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-5-fluoro-N-methyl-1H-indole-2-carboxamide
Smiles: Fc1ccc2c(c1)cc([nH]2)C(=O)N(C1CCS(=O)(=O)C1)C

STK590417
Synonyms: furan-2-yl[4-(4,5,6,7-tetrahydro-2H-indazol-3-ylcarbonyl)piperazin-1-yl]methanone
Smiles: O=C(c1[nH]nc2c1CCCC2)N1CCN(CC1)C(=O)c1ccco1

STK590421
Synonyms: 6-(butan-2-yl)-1-(pyridin-3-ylmethyl)-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: CCC(N1CNc2c(C1)c(=O)nc(n2Cc1cccnc1)S)C

STK590436
Synonyms: 4-(4-chloro-2-methylphenoxy)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)butan-1-one
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)CCCOc1ccc(cc1C)Cl

STK590440
Synonyms: [4-(4-fluorophenyl)piperazin-1-yl](5-methoxy-3-methyl-1H-indol-2-yl)methanone
Smiles: COc1ccc2c(c1)c(C)c([nH]2)C(=O)N1CCN(CC1)c1ccc(cc1)F

STK590441
Synonyms: (2R)-2-amino-4-methyl-N'-[(E)-quinoxalin-6-ylmethylidene]pentanehydrazide(non-preferredname)
Smiles: CC(C[C@H](C(=O)N/N=C/c1ccc2c(c1)nccn2)N)C

STK590442
Synonyms: 1-(1-{6-[4-(2-hydroxyethyl)piperazin-1-yl]pyrimidin-4-yl}-5-methyl-1H-pyrazol-4-yl)ethanone
Smiles: OCCN1CCN(CC1)c1ncnc(c1)n1ncc(c1C)C(=O)C

STK590445
Synonyms: 1-(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)pyrrolidinium-2-carboxylate
Smiles: CCc1nc2c3ccccc3oc2c(n1)[NH+]1CCCC1C(=O)[O-]

STK590450
Synonyms: {(5S)-3-[2-(benzyloxy)phenyl]-5-[(2,4-dimethylphenyl)carbamoyl]-4,5-dihydro-1,2-oxazol-5-yl}aceticacid
Smiles: OC(=O)C[C@]1(ON=C(C1)c1ccccc1OCc1ccccc1)C(=O)Nc1ccc(cc1C)C

STK851352
Synonyms: ethyl7-amino-3-carbamoylpyrazolo[1,5-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)c1cnc2n(c1N)ncc2C(=O)N

STK590454
Synonyms: N'-(8-bromo[1]benzofuro[3,2-d]pyrimidin-4-yl)-N,N-diethylethane-1,2-diamine
Smiles: CCN(CCNc1ncnc2c1oc1c2cc(cc1)Br)CC

STK590457
Synonyms: 7-(4-benzylpiperidin-1-yl)-5-tert-butyl-3-(4-chlorophenyl)pyrazolo[1,5-a]pyrimidine
Smiles: Clc1ccc(cc1)c1cnn2c1nc(cc2N1CCC(CC1)Cc1ccccc1)C(C)(C)C

STK590458
Synonyms: 2-[2-amino-5-(4-chlorophenyl)-6-methylpyrimidin-4-yl]-5-[(3,4-dichlorobenzyl)oxy]phenol
Smiles: Nc1nc(C)c(c(n1)c1ccc(cc1O)OCc1ccc(c(c1)Cl)Cl)c1ccc(cc1)Cl

STK590459
Synonyms: N,N-dimethyl-2-[(2-phenyl-5,6,7,8-tetrahydroquinazolin-4-yl)sulfanyl]ethanamine
Smiles: CN(CCSc1nc(nc2c1CCCC2)c1ccccc1)C

STK590461
Synonyms: 6-hydroxy-1,3,8,8-tetramethyl-5-phenyl-5,7,8,9-tetrahydropyrimido[4,5-b]quinoline-2,4(1H,3H)-dione
Smiles: OC1=C2C(=Nc3c(C2c2ccccc2)c(=O)n(c(=O)n3C)C)CC(C1)(C)C

STK851355
Synonyms: ethyl2-[(2Z)-1,3-benzothiazol-2(3H)-ylideneamino]-4-propylpyrimidine-5-carboxylate
Smiles: CCOC(=O)c1cnc(nc1CCC)/N=c/1\sc2c([nH]1)cccc2

STK590466
Synonyms: N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-(2-hydroxy-4-methylphenyl)-1H-pyrazole-3-carboxamide
Smiles: CCSc1nnc(s1)NC(=O)c1n[nH]c(c1)c1ccc(cc1O)C

STK590470
Synonyms: 2-[(3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-(3-hydroxypropyl)acetamide
Smiles: OCCCNC(=O)COc1ccc2c(c1)oc(=O)c(c2C)Cc1ccccc1

STK851356
Synonyms: N-[(2Z)-1,3-benzothiazol-2(3H)-ylidene]-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide
Smiles: O=C(c1oc2c(c1C)C(=O)CC(C2)(C)C)/N=c/1\sc2c([nH]1)cccc2

STK590472
Synonyms: 3-[4-(propan-2-yl)phenyl]-3,4-dihydro-2H-dibenzo[b,e][1,4]diazepin-1-ol
Smiles: CC(c1ccc(cc1)C1CC(=C2C(=Nc3ccccc3N=C2)C1)O)C

STK590474
Synonyms: 1-(2-methyl-5-nitro-1H-imidazol-1-yl)propan-2-ol
Smiles: CC(Cn1c(C)ncc1[N+](=O)[O-])O

STK590477
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(piperidin-1-ylmethyl)-1H-1,2,3-triazole-4-carboxylicacid
Smiles: OC(=O)c1nnn(c1CN1CCCCC1)c1nonc1N

STK590478
Synonyms: methyl(2-amino-7-hydroxy-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetate
Smiles: COC(=O)Cc1c(C)nc2n(c1O)nc(n2)N

STK590483
Synonyms: N-[(2-methylpropyl)carbamoyl]-D-leucine
Smiles: CC(CNC(=O)N[C@@H](C(=O)O)CC(C)C)C

STK590484
Synonyms: pyridin-3-yl3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxylate
Smiles: O=C(c1oc2c(c1C)C(=O)CC(C2)(C)C)Oc1cccnc1

STK590485
Synonyms: propyl4-({7-[(2,5-dimethylbenzyl)oxy]-4-oxo-4H-chromen-3-yl}oxy)benzoate
Smiles: CCCOC(=O)c1ccc(cc1)Oc1coc2c(c1=O)ccc(c2)OCc1cc(C)ccc1C

STK590489
Synonyms: N-(2-phenyl[1]benzofuro[3,2-d]pyrimidin-4-yl)-L-phenylalanine
Smiles: OC(=O)[C@@H](Nc1nc(nc2c1oc1c2cccc1)c1ccccc1)Cc1ccccc1

STK590492
Synonyms: [(5S)-5-(benzylcarbamoyl)-3-(2,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]aceticacid
Smiles: COc1cc(OC)ccc1C1=NO[C@@](C1)(CC(=O)O)C(=O)NCc1ccccc1

STK851358
Synonyms: 2-[5-(2-bromophenoxy)pyrimidin-4-yl]-5-methoxyphenol
Smiles: COc1ccc(c(c1)O)c1ncncc1Oc1ccccc1Br

STK590494
Synonyms: 8-chloro-1-methyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine
Smiles: Clc1ccc2c(c1)C(=NCc1n2c(C)nn1)c1ccccc1

STK590498
Synonyms: methylN-[(3,4-dimethoxybenzyl)carbamoyl]-D-leucinate
Smiles: COC(=O)[C@H](NC(=O)NCc1ccc(c(c1)OC)OC)CC(C)C

STK590500
Synonyms: (2E)-N-(3-bromobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-3-(furan-2-yl)prop-2-enamide
Smiles: Brc1cccc(c1)CN(C1CCS(=O)(=O)C1)C(=O)/C=C/c1ccco1

STK590501
Synonyms: 1-benzyl-N-(4-butylphenyl)-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: CCCCc1ccc(cc1)NC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1

STK590502
Synonyms: methylN-[(2,4-dimethoxybenzyl)carbamoyl]-L-valinate
Smiles: COC(=O)[C@H](C(C)C)NC(=O)NCc1ccc(cc1OC)OC

STK851359
Synonyms: N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1,9-dimethyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: O=C(c1cc2c(n1C)nc1n(c2=O)cccc1C)Nc1c(C)n(n(c1=O)c1ccccc1)C

STK590503
Synonyms: 2-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
Smiles: O=C(NC1CC(C)(C)NC(C1)(C)C)COc1ccc2c(c1)oc(=O)cc2C

STK590505
Synonyms: 1-(3,4-dimethoxyphenyl)-2-[2-(4-methoxyphenyl)ethyl]-5,7-dimethyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc(cc1)CCN1C(=O)c2c(C1c1ccc(c(c1)OC)OC)c(=O)c1c(o2)c(C)cc(c1)C

STK590506
Synonyms: (8aR)-7-[3-(trifluoromethyl)benzyl]tetrahydro[1,3]thiazolo[3,4-a]pyrazine-5,8-dione
Smiles: O=C1N(Cc2cccc(c2)C(F)(F)F)CC(=O)N2[C@H]1CSC2

STK590512
Synonyms: 2-phenyl-N-(pyridin-2-ylmethyl)[1]benzofuro[3,2-d]pyrimidin-4-amine
Smiles: c1ccc(nc1)CNc1nc(nc2c1oc1c2cccc1)c1ccccc1

STK590513
Synonyms: 6-(4-methoxyphenyl)-3-(2-methylpropyl)[1,2,4]triazolo[3,4-a]phthalazine
Smiles: COc1ccc(cc1)c1nn2c(nnc2c2c1cccc2)CC(C)C

STK851360
Synonyms: methyl4-[3-(2-hydroxyphenyl)-5-(4-methoxybenzyl)-6-oxo-2,4,5,6-tetrahydropyrrolo[3,4-c]pyrazol-4-yl]benzoate
Smiles: COc1ccc(cc1)CN1C(=O)c2c(C1c1ccc(cc1)C(=O)OC)c([nH]n2)c1ccccc1O

STK590515
Synonyms: 1-[1-(6-{[3-(dimethylamino)propyl]amino}pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]ethanone
Smiles: CN(CCCNc1ncnc(c1)n1ncc(c1C)C(=O)C)C

STK590523
Synonyms: 7-(4-fluorophenyl)-2-(2-phenylethyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Fc1ccc(cc1)n1ncc2c1ncn1c2nc(n1)CCc1ccccc1

STK590526
Synonyms: 4-amino-2'-oxo-1',2',6,7,11,12-hexahydro-10H-spiro[1,4-dioxepino[2,3-g]pyrido[2,1-a]isoquinoline-2,3'-indole]-3-carbonitrile
Smiles: N#CC1=C(N)N2CCc3c(C2=CC21C(=O)Nc1c2cccc1)cc1c(c3)OCCCO1

STK851362
Synonyms: 2-(1,3-benzothiazol-2-yl)-1-(2,4-dihydroxyphenyl)ethanone
Smiles: Oc1ccc(c(c1)O)C(=O)Cc1nc2c(s1)cccc2

STK590529
Synonyms: 2-[10-methyl-11-(4-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]phenol
Smiles: Cc1ccc(cc1)C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)c1ccccc1O)c1ccccc1

STK851363
Synonyms: 5-tert-butyl-3-(4-chlorophenyl)-7-(morpholin-4-yl)pyrazolo[1,5-a]pyrimidine
Smiles: Clc1ccc(cc1)c1cnn2c1nc(cc2N1CCOCC1)C(C)(C)C

STK590531
Synonyms: 3,3-dimethyl-3,4-dihydro-2H-dibenzo[b,e][1,4]diazepin-1-ol
Smiles: OC1=C2C=Nc3c(N=C2CC(C1)(C)C)cccc3

STK590536
Synonyms: 4-(3-methoxyphenyl)-3-methyl-5-(4-methylphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COc1cccc(c1)C1N(c2ccc(cc2)C)C(=O)c2c1c(C)[nH]n2

STK590541
Synonyms: 1-(5-benzyl-4-hydroxy-6-methylpyrimidin-2-yl)-3-(3,4-dimethylphenyl)guanidine
Smiles: N=C(Nc1ccc(c(c1)C)C)Nc1nc(C)c(c(n1)O)Cc1ccccc1

STK851367
Synonyms: N-benzyl-6,8-dimethyl-4-oxo-N-(pyridin-2-yl)-4H-chromene-2-carboxamide
Smiles: Cc1cc(C)c2c(c1)c(=O)cc(o2)C(=O)N(c1ccccn1)Cc1ccccc1

STK590545
Synonyms: 12-(furan-2-yl)-2-(4-methoxybenzyl)-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Smiles: COc1ccc(cc1)Cc1nc2n(n1)cnc1c2C(c2ccco2)C2=C(O1)CCCC2=O

STK590546
Synonyms: [4-(difluoromethoxy)-3-methoxyphenyl](6,7-dimethoxy-1-methylidene-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: COc1cc(ccc1OC(F)F)C(=O)N1CCc2c(C1=C)cc(c(c2)OC)OC

STK590550
Synonyms: 5-[(3,4-dichlorobenzyl)oxy]-2-(4-phenyl-1H-pyrazol-5-yl)phenol
Smiles: Oc1cc(ccc1c1[nH]ncc1c1ccccc1)OCc1ccc(c(c1)Cl)Cl

STK590551
Synonyms: 3-[3-(diethylamino)propyl]-5-(furan-2-yl)-4-imino-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol
Smiles: CCN(CCCn1cnc2c(c1=N)C(c1ccco1)c1c(O2)cc(cc1)O)CC

STK851372
Synonyms: N-benzyl-2-methyl-3-phenyl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-amine
Smiles: Cc1nn2c(c1c1ccccc1)nc1c(c2NCc2ccccc2)CCCC1

STK590554
Synonyms: (4E)-4-[(1-{2-hydroxy-3-[(4-methoxyphenyl)amino]propyl}-1H-indol-3-yl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1ccc(cc1)NCC(Cn1cc(c2c1cccc2)/C=C/1\C(=NN(C1=O)c1ccccc1)C)O

STK590556
Synonyms: 1-(3,4-dichlorophenyl)-2-[2-(4-methoxyphenyl)ethyl]-5,7-dimethyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc(cc1)CCN1C(=O)c2c(C1c1ccc(c(c1)Cl)Cl)c(=O)c1c(o2)c(C)cc(c1)C

STK590559
Synonyms: 8-[(2-aminoethyl)amino]-7-(4-fluorobenzyl)-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: NCCNc1nc2c(n1Cc1ccc(cc1)F)c(O)nc(=O)n2C

STK590561
Synonyms: ethyl4-{[(5-fluoro-1H-indol-2-yl)carbonyl]amino}piperidine-1-carboxylate
Smiles: CCOC(=O)N1CCC(CC1)NC(=O)c1cc2c([nH]1)ccc(c2)F

STK851374
Synonyms: 2-[(1,5-dicyano-4-hydroxy-3-azaspiro[5.5]undeca-1,3-dien-2-yl)sulfanyl]acetamide
Smiles: N#CC1C(=NC(=C(C21CCCCC2)C#N)SCC(=O)N)O

STK590569
Synonyms: 5-(phenoxymethyl)-4-{[(E)-(2,4,6-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(OC)cc(c1/C=N/n1c(COc2ccccc2)n[nH]c1=S)OC

STK590570
Synonyms: 1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-3-yl(5-methoxy-2-methyl-4-nitrophenyl)carbamate
Smiles: COc1cc(NC(=O)OC2CCN3C2=Nc2ccccc2C3)c(cc1[N+](=O)[O-])C

STK590572
Synonyms: (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(4-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)C

STK851375
Synonyms: 1-(3-methoxypropyl)-N-(naphthalen-1-yl)-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)Nc1cccc2c1cccc2

STK851376
Synonyms: 1-(4-methylphenyl)-4-(3,4,5-trimethoxyphenyl)-4,7-dihydrofuro[3,4-b]pyridine-2,5(1H,3H)-dione
Smiles: COc1c(OC)cc(cc1OC)C1CC(=O)N(C2=C1C(=O)OC2)c1ccc(cc1)C

STK851377
Synonyms: 2-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-ol
Smiles: Oc1c2CCCc2nc2n1nc(n2)C(F)(F)F

STK590585
Synonyms: ethyl4-(2,2-dimethyl-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)CCC

STK590586
Synonyms: 8-[(diethylammonio)methyl]-3-(2-methoxyphenyl)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate
Smiles: COc1ccccc1c1c(=O)c2ccc(c(c2oc1C(F)(F)F)C[NH+](CC)CC)[O-]

STK590589
Synonyms: tert-butyl(3S)-3-({(2S)-1-[(4-methoxyphenyl)amino]-1-oxopropan-2-yl}carbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
Smiles: COc1ccc(cc1)NC(=O)[C@@H](NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)C

STK590591
Synonyms: benzyl2-amino-6-(hydroxymethyl)-8-oxo-4-(pyridin-3-yl)-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate
Smiles: OCc1cc(=O)c2c(o1)C(c1cccnc1)C(=C(O2)N)C(=O)OCc1ccccc1

STK590594
Synonyms: (2R)-{[(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-4-methylpentanoyl]amino}(phenyl)ethanoicacid
Smiles: CC(C[C@H](n1c(=O)[nH]c2c(c1=O)cccc2)C(=O)N[C@H](c1ccccc1)C(=O)O)C

STK590595
Synonyms: N-[(2E)-3-(4-acetylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]cyclohexanecarboxamide
Smiles: O=C(C1CCCCC1)/N=C\1/SC2C(N1c1ccc(cc1)C(=O)C)CS(=O)(=O)C2

STK590596
Synonyms: 1'-(2-methoxyethyl)-8-nitro-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: COCCN1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CCCC1)[N+](=O)[O-]

STK851383
Synonyms: methyl[1,7-dimethyl-2,4-dioxo-8-(2-phenylethyl)-1,2,4,8-tetrahydro-3H-imidazo[2,1-f]purin-3-yl]acetate
Smiles: COC(=O)Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)CCc1ccccc1)C

STK590602
Synonyms: 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-6-methyl-N-(thiophen-2-ylmethyl)heptan-1-amine
Smiles: CC(CCC(C1CCOC(C1)(C)C)CCNCc1cccs1)C