FULL DB

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

STK617388
Synonyms: (5Z)-4-hydroxy-5-{4-[(4-iodobenzyl)oxy]-3-methoxybenzylidene}-1,3-thiazol-2(5H)-one
Smiles: COc1cc(ccc1OCc1ccc(cc1)I)/C=C/1\SC(=O)N=C1O

STK617389
Synonyms: 1-(3,4-dimethoxybenzyl)-1-[3-(morpholin-4-yl)propyl]-3-phenylthiourea
Smiles: COc1cc(ccc1OC)CN(C(=S)Nc1ccccc1)CCCN1CCOCC1

STK617394
Synonyms: 4-(5-{(E)-[1-(1,3-benzodioxol-5-yl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoicacid
Smiles: O=C1N=C(O)/C(=C\c2ccc(o2)c2ccc(cc2)C(=O)O)/C(=O)N1c1ccc2c(c1)OCO2

STK617397
Synonyms: 8-(azepanium-1-ylmethyl)-3-(2-methoxyphenyl)-2-methyl-4-oxo-4H-chromen-7-olate
Smiles: COc1ccccc1c1c(C)oc2c(c1=O)ccc(c2C[NH+]1CCCCCC1)[O-]

STK617398
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: CCC(n1cnc2c(c1=O)cccc2)C(=O)Nc1ccc2c(c1)OCCO2

STK617399
Synonyms: (E)-[1-(2-methoxyethyl)-4,5-dioxo-2-(pyridinium-3-yl)pyrrolidin-3-ylidene][3-methyl-4-(2-methylpropoxy)phenyl]methanolate
Smiles: COCCN1C(c2ccc[nH+]c2)/C(=C(/c2ccc(c(c2)C)OCC(C)C)\[O-])/C(=O)C1=O

STK617400
Synonyms: N-{3-[(3-methoxyphenyl)amino]-3-oxopropyl}-1-[(4-methoxyphenyl)sulfonyl]piperidine-3-carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)NCCC(=O)Nc1cccc(c1)OC

STK617414
Synonyms: N-[(4E)-2-(4-ethoxyphenyl)-4H-chromen-4-ylidene]-4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-amine
Smiles: CCOc1ccc(cc1)c1c/c(=N\c2sc(c(n2)c2ccc(cc2)OC)C)/c2c(o1)cccc2

STK617417
Synonyms: N-(4-methoxyphenyl)-3-methyl-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]butanamide
Smiles: COc1ccc(cc1)N(C(=O)CC(C)C)Cc1cc2ccc(cc2[nH]c1=O)C

STK617418
Synonyms: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(furan-2-yl)-1,3-oxazol-5-yl]azepane
Smiles: O=S(=O)(c1nc(oc1N1CCCCCC1)c1ccco1)c1ccc2c(c1)OCCO2

STK617420
Synonyms: 2-{[3-(2-ethoxyphenoxy)-4-oxo-4H-chromen-7-yl]oxy}-N-(pyridin-4-yl)acetamide
Smiles: CCOc1ccccc1Oc1coc2c(c1=O)ccc(c2)OCC(=O)Nc1ccncc1

STK617421
Synonyms: N-[2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]cyclopropanecarboxamide
Smiles: O=C(C1CC1)Nc1cc(ccc1C)c1nn2c(s1)nnc2C

STK617422
Synonyms: ethyl3-[(3-{(4S)-1-[2-(4-methoxyphenyl)ethyl]-2,5-dioxoimidazolidin-4-yl}propanoyl)amino]benzoate
Smiles: CCOC(=O)c1cccc(c1)NC(=O)CC[C@@H]1NC(=O)N(C1=O)CCc1ccc(cc1)OC

STK617427
Synonyms: ethyl4-{[5-(4,4-dimethyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)-2-methoxyphenyl]sulfonyl}piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)S(=O)(=O)c1cc(ccc1OC)N1C(=O)C(CS1(=O)=O)(C)C

STK617429
Synonyms: N-[2-(dimethylamino)ethyl]-2-[(5E)-5-(3-fluorobenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]acetamide
Smiles: CN(CCNC(=O)CN1C(=O)S/C(=C/c2cccc(c2)F)/C1=O)C

STK617431
Synonyms: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(4-methylphenyl)-1,3-oxazol-5-yl]piperidine-4-carboxamide
Smiles: NC(=O)C1CCN(CC1)c1oc(nc1S(=O)(=O)c1ccc2c(c1)OCCO2)c1ccc(cc1)C

STK617432
Synonyms: (4E)-1-[2-(dimethylamino)ethyl]-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-5-(pyridin-3-yl)pyrrolidine-2,3-dione
Smiles: CN(CCN1C(c2cccnc2)/C(=C(/c2ccc(cc2)OC(C)C)\O)/C(=O)C1=O)C

STK617434
Synonyms: N-(2,4-dimethoxyphenyl)-2-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Smiles: COc1cc(OC)ccc1NC(=O)c1ccc2c(c1)sc(n2)n1c(C)ccc1C

STK617435
Synonyms: 1-(2-chloro-7H-purin-6-yl)-N-[2-(2-hydroxyethoxy)ethyl]piperidine-3-carboxamide
Smiles: OCCOCCNC(=O)C1CCCN(C1)c1nc(Cl)nc2c1[nH]cn2

STK617439
Synonyms: methyl2-[(piperazin-1-ylcarbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)N2CCNCC2)sc2c1CCC2

STK617440
Synonyms: 3-(4-cyano-1-hydroxy-3-methylpyrido[1,2-a]benzimidazol-2-yl)-N-(1,3-thiazol-2-yl)propanamide
Smiles: N#Cc1c(C)c(CCC(=O)Nc2nccs2)c(n2c1nc1c2cccc1)O

STK617442
Synonyms: N-(2-chlorophenyl)-5-(1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)-2-ethoxybenzenesulfonamide
Smiles: CCOc1ccc(cc1S(=O)(=O)Nc1ccccc1Cl)N1C(=O)CCS1(=O)=O

STK617443
Synonyms: N-(3-{1-methyl-5-[(2-methylpropanoyl)amino]-1H-benzimidazol-2-yl}propyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Smiles: O=C(C(C)C)Nc1ccc2c(c1)nc(n2C)CCCNC(=O)C1COc2c(O1)cccc2

STK617444
Synonyms: 3-(4-chlorophenyl)-2-methyl-7-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]-4H-chromen-4-one
Smiles: CC1CCN(CC1)C(=O)COc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)Cl)C

STK617445
Synonyms: 1-cyclopropyl-6,7-difluoro-8-methoxy-4-oxo-N-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]-1,4-dihydroquinoline-3-carboxamide
Smiles: COc1c(F)c(F)cc2c1n(cc(c2=O)C(=O)NCCc1onc(n1)c1ccccc1)C1CC1

STK617446
Synonyms: 2-[(2-chloro-7H-purin-6-yl)sulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CSc1nc(Cl)nc2c1[nH]cn2

STK617448
Synonyms: 7-(3,4-dimethoxyphenyl)-1,3-dimethyl-8-(2-phenylethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1cc(ccc1OC)c1cn2c(n1CCc1ccccc1)nc1c2c(=O)n(C)c(=O)n1C

STK617449
Synonyms: (5E)-3-benzyl-5-[(6-hydroxy[1,3]dioxolo[4,5-g]quinolin-7-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C/c2cc3cc4OCOc4cc3nc2O)/C(=O)N1Cc1ccccc1

STK617451
Synonyms: 3-(morpholin-4-yl)-1-[5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]propan-1-one
Smiles: O=C(N1N=C(CC1c1ccc(cc1)[N+](=O)[O-])c1ccccc1)CCN1CCOCC1

STK617452
Synonyms: (5s,7s)-2-(1,2-dimethyl-1H-indol-3-yl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: O=C1[C@]2(C)CN3C[C@@]1(C)CN(C2)C3c1c(C)n(c2c1cccc2)C

STK617453
Synonyms: (5E)-5-{4-[2-(3,5-dimethylphenoxy)ethoxy]-3-methoxybenzylidene}-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: COc1cc(ccc1OCCOc1cc(C)cc(c1)C)/C=C/1\C(=NC(=O)N(C1=O)Cc1ccco1)O

STK617454
Synonyms: 8-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-4-hydroxy-1,7-dimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: Oc1nc(=O)n(c2c1n1cc(n(c1n2)CCCN1CCc2c(C1)cccc2)C)C

STK617455
Synonyms: N-(1-ethyl-2-{[(4-methylpyrimidin-2-yl)sulfanyl]methyl}-1H-benzimidazol-5-yl)-3,4-dimethoxybenzamide
Smiles: COc1cc(ccc1OC)C(=O)Nc1ccc2c(c1)nc(n2CC)CSc1nccc(n1)C

STK617456
Synonyms: 4-methyl-N-{2-[(2Z)-2-(6'-methyl-3',4'-dihydro-8'H-spiro[cyclohexane-1,2'-pyrano[3,2-g]chromen]-8'-ylidene)hydrazinyl]-2-oxo-1-phenylethyl}benzenesulfonamide
Smiles: O=C(C(c1ccccc1)NS(=O)(=O)c1ccc(cc1)C)N/N=c\1/cc(C)c2c(o1)cc1c(c2)CCC2(O1)CCCCC2

STK617461
Synonyms: 8-phenyl-N-(tetrahydrofuran-2-ylmethyl)thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-amine
Smiles: C1COC(C1)CNc1nc2sc(cc2c2n1ncn2)c1ccccc1

STK617463
Synonyms: 6-[5-(2-methylpropyl)-1H-pyrazol-3-yl]-3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: CC(Cc1[nH]nc(c1)c1nn2c(s1)nnc2C(F)(F)F)C

STK617465
Synonyms: 4-chloro-N-[(2Z)-3-[4-(dimethylamino)phenyl]-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]benzamide
Smiles: Clc1ccc(cc1)C(=O)/N=C/1\SC2C(N1c1ccc(cc1)N(C)C)CS(=O)(=O)C2

STK617470
Synonyms: 2-(6-chloro-9H-carbazol-2-yl)-N-[2-(3,4-dihydroxyphenyl)ethyl]propanamide
Smiles: O=C(C(c1ccc2c(c1)[nH]c1c2cc(cc1)Cl)C)NCCc1ccc(c(c1)O)O

STK617472
Synonyms: 1-(2-chloro-7H-purin-6-yl)-N-[3-(1H-imidazol-1-yl)propyl]piperidine-3-carboxamide
Smiles: O=C(C1CCCN(C1)c1nc(Cl)nc2c1[nH]cn2)NCCCn1cncc1

STK617473
Synonyms: N-cyclohexyl-1-(9H-purin-6-yl)piperidine-4-carboxamide
Smiles: O=C(C1CCN(CC1)c1ncnc2c1nc[nH]2)NC1CCCCC1

STK617477
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-[(4-oxo-3-phenyl-4H-chromen-7-yl)oxy]acetamide
Smiles: O=C(NC1CCS(=O)(=O)C1)COc1ccc2c(c1)occ(c2=O)c1ccccc1

STK617480
Synonyms: 7-[2-(3-methylpiperidin-1-yl)-2-oxoethoxy]-3-phenyl-4H-chromen-4-one
Smiles: CC1CCCN(C1)C(=O)COc1ccc2c(c1)occ(c2=O)c1ccccc1

STK617482
Synonyms: 2-benzyl-3-(4-hydroxy-3,5-dimethoxybenzyl)-3,4-dihydro-2H-1,2-benzothiazin-4-ol1,1-dioxide
Smiles: COc1cc(cc(c1O)OC)CC1C(O)c2ccccc2S(=O)(=O)N1Cc1ccccc1

STK617485
Synonyms: 5-imino-4-(4-methyl-1,3-thiazol-2-yl)-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-ol
Smiles: CC(N1CC(=C(C1=N)c1scc(n1)C)O)C

STK617487
Synonyms: N~2~-[(4-hydroxyphthalazin-1-yl)acetyl]-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]alaninamide
Smiles: COc1ccc2c(c1)c(CCNC(=O)C(NC(=O)Cc1nnc(c3c1cccc3)O)C)c[nH]2

STK617488
Synonyms: 1-(5-nitropyridin-2-yl)-N-(1,3-thiazol-2-yl)piperidine-4-carboxamide
Smiles: O=C(C1CCN(CC1)c1ccc(cn1)[N+](=O)[O-])Nc1nccs1

STK617490
Synonyms: 3-benzyl-5,6-dimethyl-7-(pyridin-2-ylmethyl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-imine
Smiles: Cc1c(C)c2c(n1Cc1ccccn1)ncn(c2=N)Cc1ccccc1

STK617491
Synonyms: 3-(4-methylphenyl)-1-[3-(morpholin-4-yl)propyl]-1-(naphthalen-1-ylmethyl)thiourea
Smiles: Cc1ccc(cc1)NC(=S)N(Cc1cccc2c1cccc2)CCCN1CCOCC1

STK617492
Synonyms: N-(5-methyl-1,3-thiazol-2-yl)-2-[(4-oxo-3-phenyl-4H-chromen-7-yl)oxy]acetamide
Smiles: O=C(Nc1ncc(s1)C)COc1ccc2c(c1)occ(c2=O)c1ccccc1

STK617493
Synonyms: 6-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-N-(1H-indol-5-yl)hexanamide
Smiles: O=C(Nc1ccc2c(c1)cc[nH]2)CCCCCn1c(O)nc2c(c1=O)cccc2

STK617494
Synonyms: 4-chloro-N-[2-oxo-2-(3,5,6,7-tetrahydro-1'H-spiro[imidazo[4,5-c]pyridine-4,4'-piperidin]-1'-yl)ethyl]benzamide
Smiles: Clc1ccc(cc1)C(=O)NCC(=O)N1CCC2(CC1)NCCc1c2[nH]cn1

STK617498
Synonyms: (4E)-4-[hydroxy(phenyl)methylidene]-1-[2-(morpholin-4-yl)ethyl]-5-(pyridin-2-yl)pyrrolidine-2,3-dione
Smiles: O=C1C(=O)/C(=C(\c2ccccc2)/O)/C(N1CCN1CCOCC1)c1ccccn1

STK617499
Synonyms: 2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-N-[3-methyl-2-(phenylcarbonyl)-1-benzofuran-6-yl]acetamide
Smiles: O=C(Cn1c(O)nc2c(c1=O)cccc2)Nc1ccc2c(c1)oc(c2C)C(=O)c1ccccc1

STK617500
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(2-chlorophenyl)-3-methyl-4,5-dihydro-1H-pyrazolo[3,4-b]pyridin-6-ol
Smiles: OC1=Nc2c(C(C1)c1ccc3c(c1)OCO3)c(nn2c1ccccc1Cl)C

STK617501
Synonyms: (5Z)-6-hydroxy-5-(2-methoxy-5-nitrobenzylidene)-3-[4-(propan-2-yl)phenyl]pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1/C=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)C(C)C)O)[N+](=O)[O-]

STK617502
Synonyms: 4-cyclopropyl-5-(3,4-dimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(ccc1OC)c1n[nH]c(=S)n1C1CC1

STK617503
Synonyms: 3-bromo-10-(phenylcarbonyl)-8-(tetrahydrofuran-2-ylmethyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Brc1ccc2c(c1)C=CC1N2C(C(=O)c2ccccc2)C2C1C(=O)N(C2=O)CC1CCCO1

STK617504
Synonyms: (2Z)-2-(3-chlorobenzylidene)-7-[(dipropylammonio)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cccc(c1)Cl)/C2=O)CCC

STK617506
Synonyms: (2Z)-2-(3,4-dichlorobenzylidene)-7-[(dipropylammonio)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1ccc(c(c1)Cl)Cl)/C2=O)CCC

STK617508
Synonyms: N-[2-({[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]acetyl}amino)ethyl]pyridine-4-carboxamide
Smiles: COc1ccc(cc1)c1scc(n1)CC(=O)NCCNC(=O)c1ccncc1

STK617510
Synonyms: N-(3,4-dimethoxyphenyl)-3-[(4S)-1-(4-methoxybenzyl)-2,5-dioxoimidazolidin-4-yl]propanamide
Smiles: COc1ccc(cc1)CN1C(=O)N[C@H](C1=O)CCC(=O)Nc1ccc(c(c1)OC)OC

STK617512
Synonyms: 1-(3,4-dimethoxyphenyl)-N-{[4-(4-methoxyphenyl)tetrahydro-2H-pyran-4-yl]methyl}cyclopentanecarboxamide
Smiles: COc1ccc(cc1)C1(CCOCC1)CNC(=O)C1(CCCC1)c1ccc(c(c1)OC)OC

STK617514
Synonyms: 2-(4-fluorophenyl)-N-[3-oxo-3-(3,5,6,7-tetrahydro-1'H-spiro[imidazo[4,5-c]pyridine-4,4'-piperidin]-1'-yl)propyl]acetamide
Smiles: O=C(Cc1ccc(cc1)F)NCCC(=O)N1CCC2(CC1)NCCc1c2[nH]cn1

STK617515
Synonyms: 2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-N-[3-(1H-imidazol-1-yl)propyl]acetamide
Smiles: O=C(Cn1c(O)nc2c(c1=O)cccc2)NCCCn1cncc1

STK617518
Synonyms: methyl[(2E)-2-{[(3-tert-butyl-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]imino}-2,3-dihydro-1,3-thiazol-4-yl]acetate
Smiles: COC(=O)Cc1cs/c(=N/C(=O)Cc2c(=O)oc3c(c2C)cc2c(c3)occ2C(C)(C)C)/[nH]1

STK617519
Synonyms: [1-(2-chloro-7H-purin-6-yl)piperidin-3-yl](4-phenylpiperazin-1-yl)methanone
Smiles: O=C(C1CCCN(C1)c1nc(Cl)nc2c1[nH]cn2)N1CCN(CC1)c1ccccc1

STK617521
Synonyms: 1-(4-fluorophenyl)-6,7-dimethoxy-N-{(2S)-1-[(2-methylphenyl)amino]-1-oxopropan-2-yl}-3,4-dihydroisoquinoline-2(1H)-carboxamide
Smiles: COc1cc2c(cc1OC)CCN(C2c1ccc(cc1)F)C(=O)N[C@H](C(=O)Nc1ccccc1C)C

STK617522
Synonyms: 6-amino-5-[4-hydroxy-6-(4-hydroxyphenyl)-1-methyl-2-oxo-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-1-methylpyrimidine-2,4(1H,3H)-dione
Smiles: Oc1ccc(cc1)c1[nH]c2c(c1c1c(=O)[nH]c(=O)n(c1N)C)c(O)nc(=O)n2C

STK617524
Synonyms: [3-(3,4-dichlorobenzyl)-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl]aceticacid
Smiles: OC(=O)Cn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(c(c1)Cl)Cl

STK617529
Synonyms: tert-butyl{6-[(2E)-2-(9,9-dimethyl-1,2,3,4,10,11-hexahydro-5H,9H-benzo[c]pyrano[3,2-g]chromen-5-ylidene)hydrazinyl]-6-oxohexyl}carbamate
Smiles: O=C(N/N=c\1/oc2cc3OC(C)(C)CCc3cc2c2c1CCCC2)CCCCCNC(=O)OC(C)(C)C

STK617532
Synonyms: ethyl3-[4-hydroxy-2-imino-3-(4-phenyl-1,3-thiazol-2-yl)-2,5-dihydro-1H-pyrrol-1-yl]benzoate
Smiles: CCOC(=O)c1cccc(c1)N1CC(=C(C1=N)c1scc(n1)c1ccccc1)O

STK617533
Synonyms: N-(quinolin-5-yl)-3-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanamide
Smiles: COc1cc(cc(c1OC)OC)c1noc(n1)CCC(=O)Nc1cccc2c1cccn2

STK617535
Synonyms: 2-[(2-methyl-4-oxo-3-phenoxy-4H-chromen-7-yl)oxy]-N-(pyridin-4-ylmethyl)acetamide
Smiles: O=C(NCc1ccncc1)COc1ccc2c(c1)oc(c(c2=O)Oc1ccccc1)C

STK617536
Synonyms: 5-imino-1-(3-methylbutyl)-4-(4-methyl-1,3-thiazol-2-yl)-2,5-dihydro-1H-pyrrol-3-ol
Smiles: CC(CCN1CC(=C(C1=N)c1scc(n1)C)O)C

STK617539
Synonyms: methyl2-[(3E)-3-[hydroxy(5-methylfuran-2-yl)methylidene]-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccc(o2)C)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)OC

STK617540
Synonyms: 7-{2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxoethoxy}-8-methyl-4-phenyl-2H-chromen-2-one
Smiles: OCCN1CCN(CC1)C(=O)COc1ccc2c(c1C)oc(=O)cc2c1ccccc1

STK617541
Synonyms: (2E)-2-[(methylsulfonyl)imino]-N-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1,3-benzothiazole-6-carboxamide
Smiles: COc1cc(NC(=O)c2ccc3c(c2)s/c(=N/S(=O)(=O)C)/[nH]3)cc(c1OC)OC

STK617543
Synonyms: 3-methoxy-N-[(2Z)-5-(1-phenylethyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: COc1cccc(c1)C(=O)/N=c\1/[nH]nc(s1)C(c1ccccc1)C

STK617546
Synonyms: 6-[(pyrimidin-2-ylsulfanyl)methyl]-2-[(4,6,8-trimethylquinazolin-2-yl)amino]pyrimidin-4-ol
Smiles: Oc1nc(nc(c1)CSc1ncccn1)Nc1nc(C)c2c(n1)c(C)cc(c2)C

STK617547
Synonyms: N-[1-(furan-2-ylmethyl)-5-oxo-2-phenyl-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl]-3-methoxybenzamide
Smiles: COc1cccc(c1)C(=O)NC1(N=C(N(C1=O)Cc1ccco1)c1ccccc1)C(F)(F)F

STK617548
Synonyms: (5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-6-hydroxy-3-[4-(propan-2-yl)phenyl]pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C/c2ccc3c(c2)OCO3)/C(=O)N1c1ccc(cc1)C(C)C

STK617549
Synonyms: 5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-4-(quinolin-5-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1cc(C)nc(n1)SCc1n[nH]c(=S)n1c1cccc2c1cccn2

STK617551
Synonyms: 3-[(4S)-1-(4-methoxybenzyl)-2,5-dioxoimidazolidin-4-yl]-N-(2-methoxyphenyl)propanamide
Smiles: COc1ccc(cc1)CN1C(=O)N[C@H](C1=O)CCC(=O)Nc1ccccc1OC

STK617554
Synonyms: 2-[(4-methoxybenzyl)sulfanyl]-1-(prop-2-en-1-yl)-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole5,5-dioxide
Smiles: C=CCN1C(=NC2C1CS(=O)(=O)C2)SCc1ccc(cc1)OC

STK617562
Synonyms: 3-(2,5-dimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)-N-[2-(1H-imidazol-5-yl)ethyl]propanamide
Smiles: O=C(CCc1c(=O)oc2c(c1C)cc1c(c2)oc(c1c1ccccc1)C)NCCc1cnc[nH]1

STK617563
Synonyms: (4E)-1-[3-(dimethylamino)propyl]-4-[(4-fluorophenyl)(hydroxy)methylidene]-5-(pyridin-2-yl)pyrrolidine-2,3-dione
Smiles: CN(CCCN1C(c2ccccn2)/C(=C(/c2ccc(cc2)F)\O)/C(=O)C1=O)C

STK617564
Synonyms: (4E)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[furan-2-yl(hydroxy)methylidene]-5-[3-(prop-2-en-1-yloxy)phenyl]pyrrolidine-2,3-dione
Smiles: C=CCOc1cccc(c1)C1/C(=C(/c2ccco2)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)CC

STK617566
Synonyms: (2Z)-2-(1H-indol-3-ylmethylidene)-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: O=C1/C(=C/c2c[nH]c3c2cccc3)/Oc2c1ccc(c2C[NH+]1CCOCC1)[O-]

STK617567
Synonyms: ethyl4-{[2-(3,4,5-trimethoxyphenyl)-1,3-thiazol-4-yl]acetyl}piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)Cc1csc(n1)c1cc(OC)c(c(c1)OC)OC

STK617569
Synonyms: N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N~3~-pyrimidin-2-yl-beta-alaninamide
Smiles: COc1ccc2c(c1)c(CCNC(=O)CCNc1ncccn1)c[nH]2

STK617570
Synonyms: N-(pyridin-4-yl)-N'-(pyridin-4-ylmethyl)ethanediamide
Smiles: O=C(C(=O)Nc1ccncc1)NCc1ccncc1

STK617571
Synonyms: 2-{3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]propoxy}benzonitrile
Smiles: N#Cc1ccccc1OCCCN1CCC(CC1)c1nc2c(s1)cccc2

STK617574
Synonyms: ethyl2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-hydroxypyrimidine-5-carboxylate
Smiles: CCOC(=O)c1cnc(nc1O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK617575
Synonyms: 3-[(4-{(E)-[1-(4-ethoxyphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}phenoxy)methyl]benzoicacid
Smiles: CCOc1ccc(cc1)N1C(=NC(=O)/C(=C\c2ccc(cc2)OCc2cccc(c2)C(=O)O)/C1=O)S

STK617576
Synonyms: 1-(2,4-dimethoxyphenyl)-3-{(2R)-1-[(2E)-2-(3-methoxybenzylidene)hydrazinyl]-1-oxo-3-phenylpropan-2-yl}urea(non-preferredname)
Smiles: COc1ccc(c(c1)OC)NC(=O)N[C@@H](C(=O)N/N=C/c1cccc(c1)OC)Cc1ccccc1

STK617577
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(5-methoxy-4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-3-yl)acetamide
Smiles: COc1cc2OC(C)(C)CCc2c2c1c(C)c(CC(=O)NC1CCS(=O)(=O)C1)c(=O)o2

STK617578
Synonyms: N-[1-(furan-2-ylmethyl)-2-hydroxy-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl]-3-methylbutanamide
Smiles: CC(CC(=O)NC1(N=C(N(C1=O)Cc1ccco1)O)C(F)(F)F)C

STK617579
Synonyms: methylN-[(4-benzylpiperidin-1-yl)carbonyl]-beta-alaninate
Smiles: COC(=O)CCNC(=O)N1CCC(CC1)Cc1ccccc1

STK617580
Synonyms: 1H-indol-3-yl{4-[(3,4,5-trimethoxyphenyl)carbonyl]piperazin-1-yl}methanone
Smiles: COc1cc(cc(c1OC)OC)C(=O)N1CCN(CC1)C(=O)c1c[nH]c2c1cccc2

STK617583
Synonyms: 8-(4-hydroxyphenyl)-1,7-dimethyl-3-[(2E)-3-phenylprop-2-en-1-yl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Oc1ccc(cc1)n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)C/C=C/c1ccccc1

STK617586
Synonyms: N-(quinolin-5-yl)ethanediamide
Smiles: NC(=O)C(=O)Nc1cccc2c1cccn2

STK617588
Synonyms: N-[4-(acetylamino)phenyl]-3-[(2-chloro-7H-purin-6-yl)sulfanyl]propanamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)CCSc1nc(Cl)nc2c1[nH]cn2

STK617589
Synonyms: 3-benzyl-8,8-dimethyl-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: O=c1n(cnc2c1cc1COC(Cc1n2)(C)C)Cc1ccccc1

STK617591
Synonyms: 10-methyl-3-[2-(morpholin-4-yl)ethyl]-6-propyl-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-8-one
Smiles: CCCc1cc(=O)oc2c1cc1CN(CCN3CCOCC3)COc1c2C

STK617592
Synonyms: (5E)-5-(2-methoxybenzylidene)-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazolidine-2,4-dione
Smiles: COc1ccccc1/C=C\1/SC(=O)N(C1=O)CC(=O)N1CCN(CC1)C

STK617593
Synonyms: N-methyl-N'-{2-[(pyridin-4-ylmethyl)carbamoyl]phenyl}ethanediamide
Smiles: CNC(=O)C(=O)Nc1ccccc1C(=O)NCc1ccncc1

STK617596
Synonyms: 1-[(2-oxo-1,2-dihydroquinolin-4-yl)methyl]-1-propan-2-yl-3-prop-2-en-1-ylthiourea
Smiles: C=CCNC(=S)N(C(C)C)Cc1cc(=O)[nH]c2c1cccc2

STK617597
Synonyms: 6-chloro-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-8-{[(pyridin-4-ylmethyl)ammonio]methyl}-2H-chromen-7-olate
Smiles: COC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2C[NH2+]Cc1ccncc1)[O-])Cl

STK617598
Synonyms: 2-{4,7-dimethyl-5-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}-N-(2-hydroxy-2-phenylethyl)acetamide
Smiles: CC(=C)COc1cc(C)cc2c1c(C)c(c(=O)o2)CC(=O)NCC(c1ccccc1)O

STK617599
Synonyms: (2Z)-7-{[benzyl(methyl)ammonio]methyl}-2-(2,5-dimethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: COc1ccc(c(c1)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+](Cc1ccccc1)C)[O-])OC

STK617601
Synonyms: N-(4-chlorophenyl)-4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperazine-1-carboxamide
Smiles: O=C(N1CCN(CC1)CC(=O)N1CCCC1)Nc1ccc(cc1)Cl

STK617604
Synonyms: (5E)-3-(furan-2-ylmethyl)-5-[(8-methoxyquinolin-2-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1cccc2c1nc(cc2)/C=C\1/SC(=S)N(C1=O)Cc1ccco1

STK617606
Synonyms: 5-(3,4-dimethoxyphenyl)-1-(furan-2-ylmethyl)-2-hydroxypyrido[2,3-d]pyrimidin-4(1H)-one
Smiles: COc1cc(ccc1OC)c1ccnc2c1c(=O)nc(n2Cc1ccco1)O

STK617607
Synonyms: ethyl(2,2-dimethyl-8-oxo-5-phenyl-1,8-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-9(4H)-yl)acetate
Smiles: CCOC(=O)Cn1cnc2c(c1=O)sc1c2c2CC(C)(C)OCc2c(n1)c1ccccc1

STK617608
Synonyms: N-(4-chlorophenyl)-4-[2-(2,5-dimethyl-1H-pyrrol-1-yl)ethyl]piperazine-1-carboxamide
Smiles: Clc1ccc(cc1)NC(=O)N1CCN(CC1)CCn1c(C)ccc1C

STK617611
Synonyms: N-(2-carbamoylphenyl)-1-(5-nitropyridin-2-yl)piperidine-4-carboxamide
Smiles: O=C(C1CCN(CC1)c1ccc(cn1)[N+](=O)[O-])Nc1ccccc1C(=O)N

STK617613
Synonyms: (2Z)-2-(3-methoxybenzylidene)-8-[2-(morpholin-4-yl)ethyl]-8,9-dihydro-7H-furo[2,3-f][1,3]benzoxazin-3(2H)-one
Smiles: COc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc1c2CN(CCN2CCOCC2)CO1

STK617617
Synonyms: (2E)-2-(1-benzofuran-2-ylmethylidene)-7-[(dipropylammonio)methyl]-4-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCC[NH+](Cc1c([O-])cc(c2c1O/C(=C/c1cc3c(o1)cccc3)/C2=O)C)CCC

STK617623
Synonyms: N-(2-{4-[(4-methylpiperazin-1-yl)carbonyl]piperidin-1-yl}-2-oxoethyl)benzamide
Smiles: CN1CCN(CC1)C(=O)C1CCN(CC1)C(=O)CNC(=O)c1ccccc1

STK617626
Synonyms: 1-(3-methoxypropyl)-1-[(2-oxo-1,2-dihydroquinolin-4-yl)methyl]-3-phenylurea
Smiles: COCCCN(C(=O)Nc1ccccc1)Cc1cc(=O)[nH]c2c1cccc2

STK617628
Synonyms: (4E)-4-{hydroxy[4-(prop-2-en-1-yloxy)phenyl]methylidene}-1-[2-(morpholin-4-yl)ethyl]-5-(pyridin-2-yl)pyrrolidine-2,3-dione
Smiles: C=CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccn1)CCN1CCOCC1)/O

STK617629
Synonyms: methyl4-[(3E)-3-[(4-chlorophenyl)(hydroxy)methylidene]-1-(6-ethyl-1,3-benzothiazol-2-yl)-4,5-dioxopyrrolidin-2-yl]benzoate
Smiles: CCc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1ccc(cc1)C(=O)OC

STK617630
Synonyms: 3-(1-{[4-(diphenylmethyl)piperazin-1-yl]methyl}-1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)propan-1-one
Smiles: CN1CCN(CC1)C(=O)CCc1cn(c2c1cccc2)CN1CCN(CC1)C(c1ccccc1)c1ccccc1

STK617631
Synonyms: 5-(3,4-dimethoxyphenyl)-4-(pyridin-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(ccc1OC)c1n[nH]c(=S)n1c1cccnc1

STK617632
Synonyms: N-benzyl-2-{4-[5-cyano-8-(furan-2-yl)-3,3-dimethyl-3,4-dihydro-1H-pyrano[3,4-c]pyridin-6-yl]piperazin-1-yl}-2-oxoacetamide
Smiles: N#Cc1c(nc(c2c1CC(C)(C)OC2)c1ccco1)N1CCN(CC1)C(=O)C(=O)NCc1ccccc1

STK617634
Synonyms: 2-[(4-oxo-3-phenyl-4H-chromen-7-yl)oxy]-N-(pyridin-4-yl)acetamide
Smiles: O=C(Nc1ccncc1)COc1ccc2c(c1)occ(c2=O)c1ccccc1

STK617635
Synonyms: 8-{[(1-benzylpiperidin-4-yl)ammonio]methyl}-2-oxo-4-phenyl-2H-chromen-7-olate
Smiles: O=c1cc(c2ccccc2)c2c(o1)c(C[NH2+]C1CCN(CC1)Cc1ccccc1)c(cc2)[O-]

STK617636
Synonyms: 6-amino-7-[3-(diethylamino)propyl]-3,3-dimethyl-8-thioxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: CCN(CCCn1c(N)c(C#N)c2c(c1=S)COC(C2)(C)C)CC

STK617638
Synonyms: methyl1-(2-hydroxyethyl)-2-imino-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Smiles: OCCn1c2nc3ccccn3c(=O)c2cc(c1=N)C(=O)OC

STK617639
Synonyms: N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]-N~3~-(1H-indol-3-ylacetyl)-beta-alaninamide
Smiles: O=C(NCc1cc(=O)n(c(=O)n1C)C)CCNC(=O)Cc1c[nH]c2c1cccc2

STK617643
Synonyms: 5-(4,4-dimethyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)-2-methoxy-N-(4-methoxybenzyl)benzenesulfonamide
Smiles: COc1ccc(cc1)CNS(=O)(=O)c1cc(ccc1OC)N1C(=O)C(CS1(=O)=O)(C)C

STK617645
Synonyms: (1E)-(7,10-dimethyl-5H-benzo[c]furo[3,2-g]chromen-5-ylidene)hydrazine
Smiles: N/N=c\1/oc2c(c3c1cccc3)cc1c(c2C)occ1C

STK617647
Synonyms: 1-(3,5-dimethoxyphenyl)-5-imino-4-(4-phenyl-1,3-thiazol-2-yl)-2,5-dihydro-1H-pyrrol-3-ol
Smiles: COc1cc(OC)cc(c1)N1CC(=C(C1=N)c1scc(n1)c1ccccc1)O

STK617648
Synonyms: 1-(3-hydroxypropyl)-3,9-dimethyl-7-(2-methylprop-2-en-1-yl)-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: OCCCN1N=C(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)CC(=C)C

STK617650
Synonyms: (5Z)-3-(furan-2-ylmethyl)-6-hydroxy-5-({1-[2-(4-methylphenoxy)ethyl]-1H-indol-3-yl}methylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: Cc1ccc(cc1)OCCn1cc(c2c1cccc2)/C=C\1/C(=NC(=O)N(C1=O)Cc1ccco1)O

STK617653
Synonyms: 5-imino-4-(4-methyl-1,3-thiazol-2-yl)-1-[2-(morpholin-4-yl)ethyl]-2,5-dihydro-1H-pyrrol-3-ol
Smiles: Cc1csc(n1)C1=C(O)CN(C1=N)CCN1CCOCC1

STK617655
Synonyms: N-(2-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-1-methyl-1H-benzimidazol-5-yl)cyclohexanecarboxamide
Smiles: O=C(C1CCCCC1)Nc1ccc2c(c1)nc(n2C)CSc1nc(C)cc(n1)C

STK617657
Synonyms: 1H-indol-3-yl[4-(4-methoxyphenyl)piperazin-1-yl]methanone
Smiles: COc1ccc(cc1)N1CCN(CC1)C(=O)c1c[nH]c2c1cccc2

STK617662
Synonyms: (2E)-2-{[(4-chlorophenyl)sulfonyl]imino}-N-(2-methoxyethyl)-2,3-dihydro-1,3-benzothiazole-6-carboxamide
Smiles: COCCNC(=O)c1ccc2c(c1)s/c(=N/S(=O)(=O)c1ccc(cc1)Cl)/[nH]2

STK617664
Synonyms: (5Z)-5-{[5-(4-bromophenyl)furan-2-yl]methylidene}-6-hydroxy-3-(4-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)N=C(/C(=C/c2ccc(o2)c2ccc(cc2)Br)/C1=O)O

STK617666
Synonyms: N-[2-(4-hydroxyphenyl)ethyl]-N'-{2-[(2-methoxyethyl)carbamoyl]phenyl}ethanediamide
Smiles: COCCNC(=O)c1ccccc1NC(=O)C(=O)NCCc1ccc(cc1)O

STK617670
Synonyms: 2-{4-methoxy-3-[(4-phenylpiperazin-1-yl)sulfonyl]phenyl}-4,4-dimethyl-1,2-thiazolidin-3-one1,1-dioxide
Smiles: COc1ccc(cc1S(=O)(=O)N1CCN(CC1)c1ccccc1)N1C(=O)C(CS1(=O)=O)(C)C

STK617676
Synonyms: 3-(4-methoxyphenyl)tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-imine5,5-dioxide
Smiles: COc1ccc(cc1)N1C(=N)SC2C1CS(=O)(=O)C2

STK617681
Synonyms: 6-(2-chlorobenzyl)-10,10-dimethyl-2-(pyridin-4-yl)-6,8,10,11-tetrahydro-5H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-one
Smiles: Clc1ccccc1Cn1c2sc3c(c2c2n(c1=O)nc(n2)c1ccncc1)CC(OC3)(C)C

STK617683
Synonyms: 1-(9-fluoro-6H-indolo[2,3-b]quinoxalin-6-yl)propan-2-one
Smiles: CC(=O)Cn1c2ccc(cc2c2c1nc1ccccc1n2)F

STK617684
Synonyms: 3-[(2-chloro-7H-purin-6-yl)sulfanyl]-1-[4-(2-methoxyphenyl)piperazin-1-yl]propan-1-one
Smiles: COc1ccccc1N1CCN(CC1)C(=O)CCSc1nc(Cl)nc2c1[nH]cn2

STK617685
Synonyms: N-[2-(4-fluorophenyl)ethyl]-1-(1H-indol-3-ylacetyl)piperidine-3-carboxamide
Smiles: O=C(C1CCCN(C1)C(=O)Cc1c[nH]c2c1cccc2)NCCc1ccc(cc1)F

STK617688
Synonyms: 2-amino-N-cyclohexyl-1-(3,4-dimethylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: O=C(c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)C)C)NC1CCCCC1

STK617691
Synonyms: N-[1-benzyl-2-hydroxy-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl]-3-cyclohexylpropanamide
Smiles: O=C(NC1(N=C(N(C1=O)Cc1ccccc1)O)C(F)(F)F)CCC1CCCCC1

STK617692
Synonyms: N-[2-(dimethylamino)ethyl]-2-{4-[(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]piperazin-1-yl}acetamide
Smiles: CN(CCNC(=O)CN1CCN(CC1)C(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C)C

STK617693
Synonyms: 1,3,7-trimethyl-8-{3-[2-(piperidin-1-yl)ethoxy]phenyl}-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cc1cn2c(n1c1cccc(c1)OCCN1CCCCC1)nc1c2c(=O)n(c(=O)n1C)C

STK617695
Synonyms: methyl4-(5-hydroxy-3-methyl-7-phenyl-4,6,7,8-tetrahydro[1,2]oxazolo[5,4-b]quinolin-4-yl)benzoate
Smiles: COC(=O)c1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c1c(C)no2)c1ccccc1

STK617696
Synonyms: 4-(1H-benzimidazol-2-yl)-5-imino-1-{[(E)-pyridin-3-ylmethylidene]amino}-2,5-dihydro-1H-pyrrol-3-ol
Smiles: OC1=C(c2nc3c([nH]2)cccc3)C(=N)N(C1)/N=C/c1cccnc1

STK617697
Synonyms: (4E)-5-(4-fluorophenyl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-1-[3-(1H-imidazol-1-yl)propyl]pyrrolidine-2,3-dione
Smiles: Fc1ccc(cc1)C1N(CCCn2cncc2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCc1cccc(c1)C)/O

STK617699
Synonyms: 2-(5-methoxy-4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-3-yl)-N-(2-methylphenyl)acetamide
Smiles: COc1cc2OC(C)(C)CCc2c2c1c(C)c(CC(=O)Nc1ccccc1C)c(=O)o2

STK617700
Synonyms: (6bS,9aR)-10-[(3-methoxyphenyl)carbonyl]-3,5-dimethyl-8-(prop-2-en-1-yl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: C=CCN1C(=O)[C@H]2[C@@H](C1=O)C(N1C2C=C(C)c2c1ccc(c2)C)C(=O)c1cccc(c1)OC

STK617701
Synonyms: N-(furan-2-ylmethyl)-1-(5-nitropyridin-2-yl)piperidine-3-carboxamide
Smiles: O=C(C1CCCN(C1)c1ccc(cn1)[N+](=O)[O-])NCc1ccco1

STK617702
Synonyms: 4-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-[3-(morpholin-4-yl)propyl]butanamide
Smiles: O=C(CCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)NCCCN1CCOCC1

STK617703
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4,4-dimethyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)benzenesulfonamide
Smiles: COc1cc(CCNS(=O)(=O)c2ccc(cc2)N2C(=O)C(CS2(=O)=O)(C)C)ccc1OC

STK617706
Synonyms: 8-(butan-2-yl)-3,5-dimethyl-10-(thiophen-2-ylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: CCC(N1C(=O)C2C(C1=O)C(N1C2C=C(C)c2c1ccc(c2)C)C(=O)c1cccs1)C

STK617710
Synonyms: 1-[(2Z)-5-tert-butyl-1,3,4-thiadiazol-2(3H)-ylidene]-3-(4-methoxyphenyl)urea
Smiles: COc1ccc(cc1)NC(=O)/N=c\1/[nH]nc(s1)C(C)(C)C

STK617711
Synonyms: N-[(2E)-4-ethoxy-1,3-benzothiazol-2(3H)-ylidene]benzamide
Smiles: CCOc1cccc2c1[nH]/c(=N\C(=O)c1ccccc1)/s2

STK617713
Synonyms: 1-[(4-fluorophenyl)sulfonyl]-N-{2-oxo-2-[(pyridin-4-ylmethyl)amino]ethyl}piperidine-3-carboxamide
Smiles: O=C(NCc1ccncc1)CNC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)F

STK617714
Synonyms: N-(9,10-dioxo-9,10-dihydroanthracen-1-yl)-N~2~-propan-2-ylglycinamide
Smiles: CC(NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C

STK617716
Synonyms: N-(2-{4-[(4-benzylpiperazin-1-yl)carbonyl]piperidin-1-yl}-2-oxoethyl)benzamide
Smiles: O=C(N1CCN(CC1)Cc1ccccc1)C1CCN(CC1)C(=O)CNC(=O)c1ccccc1

STK617718
Synonyms: N-(2,4-difluorophenyl)-2-(7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2)O)Nc1ccc(cc1F)F

STK617719
Synonyms: methyl4-{(E)-[3-(2-{[2-(dimethylamino)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)/C=C\1/SC(=O)N(C1=O)CC(=O)NCCN(C)C

STK617720
Synonyms: 2-(5-methoxy-4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-3-yl)-N-(2,4,6-trimethylphenyl)acetamide
Smiles: COc1cc2OC(C)(C)CCc2c2c1c(C)c(CC(=O)Nc1c(C)cc(cc1C)C)c(=O)o2

STK617722
Synonyms: 6-butyl-10-methyl-3-(pyridin-3-yl)-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-8-one
Smiles: CCCCc1cc(=O)oc2c1cc1CN(COc1c2C)c1cccnc1

STK617724
Synonyms: 8-butyl-3-chloro-10-(phenylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: CCCCN1C(=O)C2C(C1=O)C(N1C2C=Cc2c1ccc(c2)Cl)C(=O)c1ccccc1

STK617725
Synonyms: 3-cyano-N-(2-methoxyphenyl)-5-methyl-7-(pyridin-3-yl)-1,7-dihydropyrazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: COc1ccccc1NC(=O)C1=C(C)N=c2n(C1c1cccnc1)[nH]cc2C#N

STK617726
Synonyms: 6-chloro-3-[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-7-hydroxy-4-methyl-2H-chromen-2-one
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)Cc1c(=O)oc2c(c1C)cc(c(c2)O)Cl

STK617728
Synonyms: N-[(2Z)-3-(3-butoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-3-methylbutanamide
Smiles: CCCCOc1cccc(c1)N1/C(=N/C(=O)CC(C)C)/SC2C1CS(=O)(=O)C2

STK617730
Synonyms: 3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(3-methylphenyl)benzamide
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(=O)c1cc(OC)c(c(c1)OC)OC)c1cccc(c1)C

STK617733
Synonyms: N-[3-(dimethylamino)propyl]-2-[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)oxy]acetamide
Smiles: CN(CCCNC(=O)COc1ccc2c(c1)c(=O)n1c(n2)CCCCC1)C

STK617734
Synonyms: 3-[(4S)-1-(1,3-benzodioxol-5-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-(3-fluorophenyl)propanamide
Smiles: O=C(Nc1cccc(c1)F)CC[C@@H]1NC(=O)N(C1=O)Cc1ccc2c(c1)OCO2

STK617736
Synonyms: 4,7-dimethoxy-1-methyl-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]-1H-indole-2-carboxamide
Smiles: COc1ccc(c2c1n(C)c(c2)C(=O)NCC(=O)Nc1ccccn1)OC

STK617737
Synonyms: 3-(2-chloroethyl)-2-methyl-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: ClCCc1c(C)nc2n(c1=O)CCCC2

STK617739
Synonyms: N-(3,4-dimethoxybenzyl)-1H-indole-3-carboxamide
Smiles: COc1cc(CNC(=O)c2c[nH]c3c2cccc3)ccc1OC

STK617742
Synonyms: 1-cyclopropyl-1-(furan-2-ylmethyl)-3-[4-(trifluoromethyl)phenyl]thiourea
Smiles: S=C(N(C1CC1)Cc1ccco1)Nc1ccc(cc1)C(F)(F)F

STK617743
Synonyms: 4-{[2-methyl-7-(trifluoromethyl)quinolin-4-yl]amino}benzoicacid
Smiles: Cc1cc(Nc2ccc(cc2)C(=O)O)c2c(n1)cc(cc2)C(F)(F)F

STK617744
Synonyms: 6-methyl-9-(prop-2-en-1-yl)-2,3,9,10-tetrahydro-8H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(1H)-one
Smiles: C=CCN1COc2c(C1)cc1c(c2C)oc(=O)c2c1CCC2

STK617746
Synonyms: 6-(2,3-dihydro-1H-indol-1-ylcarbonyl)-2-phenyl-4,5-dihydropyridazin-3(2H)-one
Smiles: O=C1CCC(=NN1c1ccccc1)C(=O)N1CCc2c1cccc2

STK617747
Synonyms: 4-(4,5-dimethyl-1,3-thiazol-2-yl)-5-imino-1-(2,2,6,6-tetramethylpiperidin-4-yl)-2,5-dihydro-1H-pyrrol-3-ol
Smiles: OC1=C(c2sc(c(n2)C)C)C(=N)N(C1)C1CC(C)(C)NC(C1)(C)C

STK617748
Synonyms: methyl2-{(3E)-2-(4-ethoxyphenyl)-3-[hydroxy(5-methylfuran-2-yl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2ccc(o2)C)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)OC

STK617749
Synonyms: N-[2-(4-methoxyphenyl)ethyl]-1-(9H-purin-6-yl)piperidine-4-carboxamide
Smiles: COc1ccc(cc1)CCNC(=O)C1CCN(CC1)c1ncnc2c1nc[nH]2

STK617750
Synonyms: N-[2-hydroxy-5-oxo-1-(2-phenylethyl)-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl]-2-phenylacetamide
Smiles: O=C(NC1(N=C(N(C1=O)CCc1ccccc1)O)C(F)(F)F)Cc1ccccc1

STK617753
Synonyms: 1-(3-chlorophenyl)-3-methyl-4-(thiophen-3-yl)-4,5-dihydro-1H-pyrazolo[3,4-b]pyridin-6-ol
Smiles: Clc1cccc(c1)n1nc(c2c1N=C(O)CC2c1cscc1)C

STK617754
Synonyms: 2-(2-methoxyphenyl)-8-nitro-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazole
Smiles: COc1ccccc1N1CCn2c(C1)nc1c2ccc(c1)[N+](=O)[O-]

STK617755
Synonyms: 2-[(5Z)-5-(3-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[2-(4-hydroxyphenyl)ethyl]propanamide
Smiles: O=C(C(N1C(=S)S/C(=C\c2cccc(c2)F)/C1=O)C)NCCc1ccc(cc1)O

STK617756
Synonyms: 4-(2-hydroxyethyl)-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: OCCn1c(n[nH]c1=S)c1ccncc1

STK617757
Synonyms: 1-(5-chloro-2-methoxyphenyl)-3-(4-hydroxy-5,6,7,8-tetrahydroquinazolin-2-yl)guanidine
Smiles: COc1ccc(cc1NC(=N)Nc1nc(O)c2c(n1)CCCC2)Cl

STK617758
Synonyms: methyl4-{(Z)-[3-(2-{[3-(dimethylamino)propyl]amino}-2-oxoethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CC(=O)NCCCN(C)C

STK617765
Synonyms: 3,3,8-trimethyl-6-{4-[oxo(pyrrolidin-1-yl)acetyl]piperazin-1-yl}-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: N#Cc1c(nc(c2c1CC(C)(C)OC2)C)N1CCN(CC1)C(=O)C(=O)N1CCCC1

STK617767
Synonyms: 1-(3-methoxyphenyl)-2-phenyl-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
Smiles: COc1cccc(c1)n1c(nc(=S)c2c1CCCC2)c1ccccc1

STK617768
Synonyms: (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(4-methoxyphenyl)-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)C1N(c2nccs2)C(=O)C(=O)/C/1=C(\c1cc2c(o1)cccc2)/O

STK617769
Synonyms: N-(heptan-2-yl)-1-(9H-purin-6-yl)piperidine-4-carboxamide
Smiles: CCCCCC(NC(=O)C1CCN(CC1)c1ncnc2c1nc[nH]2)C

STK617770
Synonyms: 2-[(9-oxo-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-7-yl)oxy]-N,N-dipropylacetamide
Smiles: CCCN(C(=O)COc1ccc2c(c1)c(=O)n1c(n2)CCC1)CCC

STK617771
Synonyms: 1-(4-benzylpiperazin-1-yl)-2-[2-(3,4,5-trimethoxyphenyl)-1,3-thiazol-4-yl]ethanone
Smiles: COc1cc(cc(c1OC)OC)c1scc(n1)CC(=O)N1CCN(CC1)Cc1ccccc1

STK617772
Synonyms: N-(3-chlorophenyl)-4-(pyrimidin-2-yl)-1,4-diazepane-1-carboxamide
Smiles: Clc1cccc(c1)NC(=O)N1CCCN(CC1)c1ncccn1

STK617773
Synonyms: N-[1-(1,1-dioxidotetrahydrothiophen-3-yl)-3-phenyl-1H-pyrazol-5-yl]-2-methoxybenzamide
Smiles: COc1ccccc1C(=O)Nc1cc(nn1C1CCS(=O)(=O)C1)c1ccccc1

STK617776
Synonyms: N-[2-(4-methoxyphenyl)ethyl]-1H-indole-3-carboxamide
Smiles: COc1ccc(cc1)CCNC(=O)c1c[nH]c2c1cccc2

STK617777
Synonyms: N-(9-ethyl-9H-carbazol-3-yl)-3-[(4S)-1-(4-methoxybenzyl)-2,5-dioxoimidazolidin-4-yl]propanamide
Smiles: COc1ccc(cc1)CN1C(=O)N[C@H](C1=O)CCC(=O)Nc1ccc2c(c1)c1ccccc1n2CC

STK617779
Synonyms: ethyl4-[(2,3,4,9-tetramethyl-7-oxo-7H-furo[2,3-f]chromen-8-yl)acetyl]piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)Cc1c(=O)oc2c(c1C)c1oc(c(c1c(c2)C)C)C

STK617781
Synonyms: N-(4-bromophenyl)-2-[(5-hydroxy-6-phenyl-1,2,4-triazin-3-yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nnc(c(n1)O)c1ccccc1

STK617783
Synonyms: 5-amino-1-(2-ethoxyphenyl)-N-(3-methoxybenzyl)-1H-1,2,3-triazole-4-carboxamide
Smiles: CCOc1ccccc1n1nnc(c1N)C(=O)NCc1cccc(c1)OC

STK617784
Synonyms: N-(3-fluorophenyl)-2-(7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2)O)Nc1cccc(c1)F

STK617785
Synonyms: N-(2,5-dimethoxyphenyl)-2-{[3-(4-methoxyphenyl)-2-methyl-4-oxo-4H-chromen-7-yl]oxy}acetamide
Smiles: COc1ccc(cc1)c1c(C)oc2c(c1=O)ccc(c2)OCC(=O)Nc1cc(OC)ccc1OC

STK617788
Synonyms: methyl4-({[5-(4,4-dimethyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)-2-methoxyphenyl]sulfonyl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)NS(=O)(=O)c1cc(ccc1OC)N1C(=O)C(CS1(=O)=O)(C)C

STK617789
Synonyms: 3-{2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-4-methyl-2-oxo-2H-chromene-5,7-diyldiacetate
Smiles: CC(=O)Oc1cc(OC(=O)C)cc2c1c(C)c(c(=O)o2)CC(=O)N1CCN(CC1)c1ccc(cc1)Cl

STK617790
Synonyms: (2Z)-2-(1H-indol-3-ylmethylidene)-7-[(2-methylpiperidinium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: O=C1/C(=C/c2c[nH]c3c2cccc3)/Oc2c1ccc(c2C[NH+]1CCCCC1C)[O-]

STK617795
Synonyms: 4-(2-{[3-(3-tert-butyl-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]amino}ethyl)phenylacetate
Smiles: O=C(CCc1c(=O)oc2c(c1C)cc1c(c2)occ1C(C)(C)C)NCCc1ccc(cc1)OC(=O)C

STK617798
Synonyms: 4-(4-hydroxy-3,5-dimethoxyphenyl)-3-methyl-7-phenyl-4,6,7,8-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5-ol
Smiles: COc1cc(cc(c1O)OC)C1C2=C(O)CC(CC2=Nc2c1c(C)no2)c1ccccc1

STK617802
Synonyms: 3-[(2-chloro-7H-purin-6-yl)sulfanyl]-N-(4-methoxyphenyl)propanamide
Smiles: COc1ccc(cc1)NC(=O)CCSc1nc(Cl)nc2c1[nH]cn2

STK617804
Synonyms: (4E)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-1-(5-methyl-1,2-oxazol-3-yl)-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1cc(cc(c1OC)OC)C1N(c2noc(c2)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OC(C)C)/O

STK617807
Synonyms: 6-(4-methoxyphenyl)-2-[(naphthalen-1-ylmethyl)sulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile
Smiles: N#Cc1c(SCc2cccc3c2cccc3)nc(cc1C(F)(F)F)c1ccc(cc1)OC

STK617808
Synonyms: 5-(2-chlorobenzyl)-2-[(6-methoxy-4-methylquinazolin-2-yl)amino]-6-methylpyrimidin-4-ol
Smiles: COc1ccc2c(c1)c(C)nc(n2)Nc1nc(C)c(c(n1)O)Cc1ccccc1Cl

STK617813
Synonyms: [2-(3,4-dimethoxyphenyl)-4-methyl-1,3-thiazol-5-yl][4-(2-fluorophenyl)piperazin-1-yl]methanone
Smiles: COc1cc(ccc1OC)c1nc(c(s1)C(=O)N1CCN(CC1)c1ccccc1F)C

STK617814
Synonyms: N-(furan-2-ylmethyl)-3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)propanamide
Smiles: O=C(NCc1ccco1)CCc1c(=O)oc2c(c1C)ccc(c2)O

STK617815
Synonyms: (4E)-5-(4-fluorophenyl)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: CC(Oc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)F)c1noc(c1)C)/O)C

STK617816
Synonyms: (5E)-5-[(6-hydroxy[1,3]dioxolo[4,5-g]quinolin-7-yl)methylidene]-3-phenyl-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C/c2cc3cc4OCOc4cc3nc2O)/C(=O)N1c1ccccc1

STK617819
Synonyms: 1-(4-fluorobenzyl)-3-(furan-2-ylmethyl)-4-imino-6,6-dimethyl-1,3,4,5,6,8-hexahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-one
Smiles: Fc1ccc(cc1)Cn1c(=O)n(Cc2ccco2)c(=N)c2c1sc1c2CC(OC1)(C)C

STK617820
Synonyms: 7,9-dimethyl-1-[2-(morpholin-4-yl)ethyl]-3-phenyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: Cn1c(=O)n(C)c(=O)c2c1nc1n2CC(=NN1CCN1CCOCC1)c1ccccc1

STK617821
Synonyms: 4-methyl-2-{3-methyl-4-[(4-phenylpiperazin-1-yl)sulfonyl]phenyl}-1,2-thiazolidin-3-one1,1-dioxide
Smiles: O=C1C(C)CS(=O)(=O)N1c1ccc(c(c1)C)S(=O)(=O)N1CCN(CC1)c1ccccc1

STK617823
Synonyms: N-{(2S)-1-[(1,3-benzodioxol-5-ylmethyl)amino]-1-oxopropan-2-yl}-1-[(4-fluorophenyl)sulfonyl]piperidine-3-carboxamide
Smiles: Fc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)N[C@H](C(=O)NCc1ccc2c(c1)OCO2)C

STK617824
Synonyms: N'-(10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)-N,N-dimethylethane-1,2-diamine
Smiles: CN(CCNc1nc2sc3c(c2c2n1ncn2)CC(OC3)(C)C)C

STK617825
Synonyms: N-[(2S)-1-(cyclopropylamino)-4-(methylsulfanyl)-1-oxobutan-2-yl]-1-[(4-fluorophenyl)sulfonyl]piperidine-4-carboxamide
Smiles: CSCC[C@@H](C(=O)NC1CC1)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)F

STK617826
Synonyms: 1-(4-methoxyphenyl)-1-[(2-oxo-1,2-dihydroquinolin-4-yl)methyl]-3-phenylthiourea
Smiles: COc1ccc(cc1)N(C(=S)Nc1ccccc1)Cc1cc(=O)[nH]c2c1cccc2

STK617828
Synonyms: (4E)-1-[2-(dimethylamino)ethyl]-4-[hydroxy(3-methoxyphenyl)methylidene]-5-(pyridin-4-yl)pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1ccncc1)CCN(C)C)/O

STK617829
Synonyms: 1-amino-4-(1H-benzimidazol-2-yl)-5-imino-2,5-dihydro-1H-pyrrol-3-ol
Smiles: NN1CC(=C(C1=N)c1nc2c([nH]1)cccc2)O

STK617832
Synonyms: 6-(2-methoxyphenyl)-2-[(4,6,7-trimethylquinazolin-2-yl)amino]pyrimidin-4-ol
Smiles: COc1ccccc1c1nc(nc(c1)O)Nc1nc(C)c2c(n1)cc(c(c2)C)C

STK617833
Synonyms: ethyl1-[3-(4-oxoquinazolin-3(4H)-yl)propanoyl]piperidine-3-carboxylate
Smiles: CCOC(=O)C1CCCN(C1)C(=O)CCn1cnc2c(c1=O)cccc2

STK617837
Synonyms: methylN-[(1-cyclopropyl-6,7-difluoro-8-methoxy-4-oxo-1,4-dihydroquinolin-3-yl)carbonyl]-L-phenylalaninate
Smiles: COC(=O)[C@@H](NC(=O)c1cn(C2CC2)c2c(c1=O)cc(c(c2OC)F)F)Cc1ccccc1

STK617838
Synonyms: methyl4,5-dimethyl-2-({[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}amino)thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)COc2ccc3c(c2)oc(=O)cc3C)sc(c1C)C

STK617839
Synonyms: N-(1-benzylpiperidin-4-yl)-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide
Smiles: O=C(c1sc(nc1C)c1ccccc1)NC1CCN(CC1)Cc1ccccc1

STK617840
Synonyms: 7-{2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxoethoxy}spiro[chromene-2,1'-cyclohexan]-4(3H)-one
Smiles: OC[C@@H]1CCCN1C(=O)COc1ccc2c(c1)OC1(CC2=O)CCCCC1

STK617844
Synonyms: ethyl3-{[(2-hydroxyethyl)(methyl)carbamoyl]amino}-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-b]thieno[3,2-e]pyridine-2-carboxylate
Smiles: OCCN(C(=O)Nc1c(sc2c1cc1COC(Cc1n2)(C)C)C(=O)OCC)C

STK617845
Synonyms: N-benzyl-2-[2,2-dimethyl-8-oxo-5-(propan-2-yl)-1,8-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-9(4H)-yl]acetamide
Smiles: O=C(Cn1cnc2c(c1=O)sc1c2c2CC(C)(C)OCc2c(n1)C(C)C)NCc1ccccc1

STK617849
Synonyms: ethyl3-(7-hydroxy-5-methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanoate
Smiles: CCOC(=O)CCc1c(C)nc2n(c1O)nc(n2)c1ccccc1

STK617851
Synonyms: 3-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-N-(pyridin-2-ylmethyl)propanamide
Smiles: O=C(CCn1c(O)nc2c(c1=O)cccc2)NCc1ccccn1

STK617855
Synonyms: (5Z)-5-[(5-methoxy-1H-indol-3-yl)methylidene]-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1ccc2c(c1)c(c[nH]2)/C=C/1\SC(=S)N(C1=O)CCc1ccccc1

STK617857
Synonyms: 5-(furan-2-yl)-1-(furan-2-ylmethyl)-2-hydroxypyrido[2,3-d]pyrimidin-4(1H)-one
Smiles: O=c1nc(O)n(c2c1c(ccn2)c1ccco1)Cc1ccco1

STK617859
Synonyms: 3-methyl-N-(1-methyl-2-{[(4-methylpyrimidin-2-yl)sulfanyl]methyl}-1H-benzimidazol-5-yl)benzamide
Smiles: Cc1cccc(c1)C(=O)Nc1ccc2c(c1)nc(n2C)CSc1nccc(n1)C

STK617860
Synonyms: 1-[(4-chlorophenyl)sulfonyl]-N-{2-oxo-2-[(pyridin-4-ylmethyl)amino]ethyl}piperidine-3-carboxamide
Smiles: O=C(NCc1ccncc1)CNC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)Cl

STK617861
Synonyms: (4E)-5-(3,4-dimethoxyphenyl)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)/C(=C\1/C(c2ccc(c(c2)OC)OC)N(C(=O)C1=O)c1nc2c(s1)cc(cc2C)C)/O

STK617862
Synonyms: (5E)-3-(4-methoxyphenyl)-5-(quinoxalin-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1ccc(cc1)N1C(=S)S/C(=C/c2cnc3c(n2)cccc3)/C1=O

STK617865
Synonyms: 3-{1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl}-2-hydroxyquinazolin-4(3H)-one
Smiles: CC(C(n1c(O)nc2c(c1=O)cccc2)C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2)C

STK617866
Synonyms: 2-{4-[4-cyano-1-(furan-2-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]piperazin-1-yl}-N-(2-methoxyethyl)-2-oxoacetamide
Smiles: COCCNC(=O)C(=O)N1CCN(CC1)c1nc(c2ccco2)c2c(c1C#N)CCCC2

STK617867
Synonyms: 2-[(2-chloro-7H-purin-6-yl)sulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
Smiles: O=C(CSc1nc(Cl)nc2c1[nH]cn2)NCCc1ccc(cc1)S(=O)(=O)N

STK617868
Synonyms: N-[(2Z)-3-(3-chlorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-1,3-benzodioxole-5-carboxamide
Smiles: Clc1cccc(c1)N1/C(=N/C(=O)c2ccc3c(c2)OCO3)/SC2C1CS(=O)(=O)C2

STK617872
Synonyms: 5-bromo-N-[4-(methylsulfanyl)-1-oxo-1-(3,5,6,7-tetrahydro-1'H-spiro[imidazo[4,5-c]pyridine-4,4'-piperidin]-1'-yl)butan-2-yl]furan-2-carboxamide
Smiles: CSCCC(C(=O)N1CCC2(CC1)NCCc1c2[nH]cn1)NC(=O)c1ccc(o1)Br

STK617876
Synonyms: 5-bromo-N-[2-(piperidin-1-ylsulfonyl)ethyl]-N-(pyridin-3-ylmethyl)furan-2-carboxamide
Smiles: Brc1ccc(o1)C(=O)N(Cc1cccnc1)CCS(=O)(=O)N1CCCCC1

STK617878
Synonyms: N-{1-[1-(3,4-dichlorobenzyl)-1H-benzimidazol-2-yl]-2-methylpropyl}benzamide
Smiles: O=C(c1ccccc1)NC(c1nc2c(n1Cc1ccc(c(c1)Cl)Cl)cccc2)C(C)C

STK617879
Synonyms: 1-{[4-(acetylamino)phenyl]sulfonyl}-N-(3-methoxybenzyl)piperidine-3-carboxamide
Smiles: COc1cccc(c1)CNC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)NC(=O)C

STK617880
Synonyms: (4E)-1-[2-(dimethylamino)ethyl]-5-(2-fluorophenyl)-4-[hydroxy(4-methoxyphenyl)methylidene]pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)CCN(C)C)/O

STK617881
Synonyms: 2-(2-chlorophenoxy)-N-[2-(furan-2-yl)-2-(pyrrolidin-1-yl)ethyl]acetamide
Smiles: O=C(NCC(c1ccco1)N1CCCC1)COc1ccccc1Cl

STK617884
Synonyms: 1-[(5-chloro-1-benzofuran-2-yl)carbonyl]piperidine-4-carboxamide
Smiles: NC(=O)C1CCN(CC1)C(=O)c1cc2c(o1)ccc(c2)Cl

STK617886
Synonyms: N-(4-chlorophenyl)-2-hydroxy-4-methyl-6-phenyl-1,6-dihydropyrimidine-5-carboxamide
Smiles: Clc1ccc(cc1)NC(=O)C1=C(C)N=C(NC1c1ccccc1)O

STK617888
Synonyms: 2-(2-hydroxyphenyl)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-ol
Smiles: Oc1ccccc1c1nn2c(n1)c1c(nc2O)sc2c1CC(C)(C)OC2

STK617889
Synonyms: 5-amino-N-(3-chloro-4-methoxyphenyl)-1-(4-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
Smiles: COc1ccc(cc1)n1nnc(c1N)C(=O)Nc1ccc(c(c1)Cl)OC

STK617890
Synonyms: 4-(4-bromophenyl)-3-methyl-1-phenyl-1H-pyrazolo[4',3':5,6]pyrido[2,3-d]pyrimidine-5,7-diol
Smiles: Brc1ccc(cc1)c1c2c(C)nn(c2nc2c1c(O)nc(n2)O)c1ccccc1

STK617891
Synonyms: 6-{[(4-ethoxyphenyl)amino]methyl}-7-hydroxy-8-methyl-4-propyl-2H-chromen-2-one
Smiles: CCCc1cc(=O)oc2c1cc(CNc1ccc(cc1)OCC)c(c2C)O

STK617892
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(6-ethyl-1,3-benzothiazol-2-yl)-5-(4-propoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)CC

STK617893
Synonyms: 5-(4-fluorobenzyl)-8-methoxy-3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5H-[1,2,4]triazino[5,6-b]indole
Smiles: COc1ccc2c(c1)c1nnc(nc1n2Cc1ccc(cc1)F)SCCN1CCOCC1

STK617894
Synonyms: 1-(9H-purin-6-yl)-N-[4-(trifluoromethoxy)phenyl]piperidine-4-carboxamide
Smiles: O=C(C1CCN(CC1)c1ncnc2c1nc[nH]2)Nc1ccc(cc1)OC(F)(F)F

STK617895
Synonyms: (1'S,3S,3'S)-3'-[(4-bromophenyl)carbonyl]-1'-[(3,4,5-trimethoxyphenyl)carbonyl]-1',10b'-dihydrospiro[indole-3,2'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1cc(cc(c1OC)OC)C(=O)[C@@H]1C2c3ccccc3C=CN2[C@@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccc(cc1)Br

STK617897
Synonyms: 8-(3-methoxypropyl)-10-[(3-nitrophenyl)carbonyl]-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COCCCN1C(=O)C2C(C1=O)C(N1C2C=Cc2c1cccc2)C(=O)c1cccc(c1)[N+](=O)[O-]

STK617898
Synonyms: 2-[4-(2-methylpropoxy)phenyl]-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-ol
Smiles: CC(COc1ccc(cc1)c1nn2c(n1)c1c(nc2O)sc2c1CCC2)C

STK617899
Synonyms: 4-(4,5-dimethyl-1,3-thiazol-2-yl)-5-imino-1-(4-phenoxyphenyl)-2,5-dihydro-1H-pyrrol-3-ol
Smiles: OC1=C(c2sc(c(n2)C)C)C(=N)N(C1)c1ccc(cc1)Oc1ccccc1

STK617901
Synonyms: (4E)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-(4-methylphenyl)-1-[2-(morpholin-4-yl)ethyl]pyrrolidine-2,3-dione
Smiles: Cc1ccc(cc1)C1N(CCN2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCc1cccc(c1)C)/O

STK617903
Synonyms: N~2~-(2-chloro-7H-purin-6-yl)-N-[2-(4-methoxyphenyl)ethyl]glycinamide
Smiles: COc1ccc(cc1)CCNC(=O)CNc1nc(Cl)nc2c1[nH]cn2

STK617905
Synonyms: N-{4-[5-hydroxy-7-(4-hydroxyphenyl)-3-methyl-4,6,7,8-tetrahydro[1,2]oxazolo[5,4-b]quinolin-4-yl]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c1c(C)no2)c1ccc(cc1)O

STK617907
Synonyms: (4E)-5-(4-ethoxyphenyl)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-(6-ethyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)OCC)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)CC

STK617909
Synonyms: 3,4-dimethoxy-N-[4-(1H-1,2,4-triazol-1-ylmethyl)phenyl]benzamide
Smiles: COc1cc(ccc1OC)C(=O)Nc1ccc(cc1)Cn1cncn1

STK617910
Synonyms: 7-(3,5-dimethyl-1H-pyrazol-1-yl)-3-(4-fluorophenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidine
Smiles: Fc1ccc(cc1)c1c(C)nn2c1nc(C)cc2n1nc(cc1C)C

STK617911
Synonyms: 4-(2,4-dimethoxyphenyl)-1-(4-methoxyphenyl)-3-phenyl-4,5-dihydro-1H-pyrazolo[3,4-b]pyridin-6-ol
Smiles: COc1ccc(cc1)n1nc(c2c1N=C(O)CC2c1ccc(cc1OC)OC)c1ccccc1

STK617912
Synonyms: 5-amino-1-(4-fluorophenyl)-N-(4-methoxybenzyl)-1H-1,2,3-triazole-4-carboxamide
Smiles: COc1ccc(cc1)CNC(=O)c1nnn(c1N)c1ccc(cc1)F

STK617914
Synonyms: 1-cyclopropyl-7-(4-ethylpiperazin-1-yl)-6-fluoro-4-oxo-N-(pyridin-3-yl)-1,4-dihydroquinoline-3-carboxamide
Smiles: CCN1CCN(CC1)c1cc2c(cc1F)c(=O)c(cn2C1CC1)C(=O)Nc1cccnc1

STK617917
Synonyms: 2-{[3-(4-chlorophenyl)-2-methyl-4-oxo-4H-chromen-7-yl]oxy}-N-[2-(2-hydroxyethoxy)ethyl]acetamide
Smiles: OCCOCCNC(=O)COc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)Cl)C

STK617918
Synonyms: N-[2-(dimethylamino)ethyl]-1-(5-nitropyridin-2-yl)piperidine-3-carboxamide
Smiles: CN(CCNC(=O)C1CCCN(C1)c1ccc(cn1)[N+](=O)[O-])C

STK617919
Synonyms: 2-(5-methoxy-4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-3-yl)-N-[4-(1H-1,2,4-triazol-1-ylmethyl)phenyl]acetamide
Smiles: COc1cc2OC(C)(C)CCc2c2c1c(C)c(CC(=O)Nc1ccc(cc1)Cn1cncn1)c(=O)o2

STK617920
Synonyms: methyl2-{(3E)-2-(4-fluorophenyl)-3-[hydroxy(4-methylphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: COC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/O)/C1c1ccc(cc1)F

STK617922
Synonyms: N-(4,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl)-N'-[2-(1H-indol-3-yl)ethyl]ethanediamide
Smiles: Cc1cc(C)c2c(n1)[nH]nc2NC(=O)C(=O)NCCc1c[nH]c2c1cccc2

STK617924
Synonyms: N-(3-hydroxypropyl)-N'-(2-phenyl-1H-indol-3-yl)ethanediamide
Smiles: OCCCNC(=O)C(=O)Nc1c([nH]c2c1cccc2)c1ccccc1

STK617925
Synonyms: 1-(3,4-dihydroxyphenyl)-2-{[5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: O=C(c1ccc(c(c1)O)O)CSc1nnc([nH]1)c1cccnc1

STK617926
Synonyms: N-(4-ethoxyphenyl)-3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: CCOc1ccc(cc1)N(C(=O)c1cc(OC)c(c(c1)OC)OC)Cc1cc2cc(OC)ccc2[nH]c1=O

STK617928
Synonyms: 2-(4-{[4-(2-hydroxyethyl)piperazin-1-yl]carbonothioyl}-2-methoxyphenoxy)acetamide
Smiles: OCCN1CCN(CC1)C(=S)c1ccc(c(c1)OC)OCC(=O)N

STK617929
Synonyms: 1-(3-chlorophenyl)-4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-5-imino-2,5-dihydro-1H-pyrrol-3-ol
Smiles: COc1cc(ccc1OC)c1csc(n1)C1=C(O)CN(C1=N)c1cccc(c1)Cl

STK617930
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-5-(4-ethoxyphenyl)-1-[2-(morpholin-4-yl)ethyl]pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1CCN1CCOCC1

STK617931
Synonyms: 6-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-3,5-dimethyl-7H-furo[3,2-g]chromen-7-one
Smiles: O=C(N1CCN(CC1)c1ccccc1F)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1C

STK617932
Synonyms: N-(3-acetylphenyl)-4-(4,4-dimethyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)benzenesulfonamide
Smiles: O=C1N(c2ccc(cc2)S(=O)(=O)Nc2cccc(c2)C(=O)C)S(=O)(=O)CC1(C)C

STK617935
Synonyms: 6-benzyl-3-{[2-(2-methoxyphenoxy)ethyl]sulfanyl}-1,2,4-triazin-5-ol
Smiles: COc1ccccc1OCCSc1nnc(c(n1)O)Cc1ccccc1

STK617936
Synonyms: 2-(9-methyl-4-oxo-7-phenylthieno[2,3-d:4,5-d']dipyrimidin-3(4H)-yl)acetamide
Smiles: NC(=O)Cn1cnc2c(c1=O)sc1c2c(C)nc(n1)c1ccccc1

STK617937
Synonyms: N-[(2E)-6-[(4-acetylpiperazin-1-yl)carbonyl]-1,3-benzothiazol-2(3H)-ylidene]benzenesulfonamide
Smiles: CC(=O)N1CCN(CC1)C(=O)c1ccc2c(c1)s/c(=N/S(=O)(=O)c1ccccc1)/[nH]2

STK617939
Synonyms: N-(3-{1-methyl-5-[(3-methylbutanoyl)amino]-1H-benzimidazol-2-yl}propyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Smiles: CC(CC(=O)Nc1ccc2c(c1)nc(n2C)CCCNC(=O)C1COc2c(O1)cccc2)C

STK617940
Synonyms: N-(furan-2-ylmethyl)-2-(2,2,5-trimethyl-8-oxo-1,8-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-9(4H)-yl)acetamide
Smiles: O=C(Cn1cnc2c(c1=O)sc1c2c2CC(C)(C)OCc2c(n1)C)NCc1ccco1

STK617941
Synonyms: (2Z)-7-[(dipropylammonio)methyl]-2-(4-ethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCOc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+](CCC)CCC)[O-]

STK617943
Synonyms: methyl5,5-dimethyl-2-({[4-(2-methylprop-2-en-1-yl)piperazin-1-yl]carbonyl}amino)-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)N2CCN(CC2)CC(=C)C)sc2c1CC(C)(C)OC2

STK617945
Synonyms: 8-(3-methoxypropyl)-10-[(4-nitrophenyl)carbonyl]-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COCCCN1C(=O)C2C(C1=O)C(N1C2C=Cc2c1cccc2)C(=O)c1ccc(cc1)[N+](=O)[O-]

STK617946
Synonyms: N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-fluorophenoxy)propanamide
Smiles: O=C(C(Oc1ccc(cc1)F)C)NCC(c1ccco1)N(C)C

STK617947
Synonyms: (5E)-5-(5-bromo-2-hydroxy-3-methoxybenzylidene)-6-hydroxy-3-[4-(propan-2-yl)phenyl]pyrimidine-2,4(3H,5H)-dione
Smiles: COc1cc(Br)cc(c1O)/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)C(C)C)O

STK617948
Synonyms: N-[(2S)-1-(cyclopentylamino)-1-oxopropan-2-yl]-1-(4-fluorophenyl)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carboxamide
Smiles: COc1cc2c(cc1OC)CCN(C2c1ccc(cc1)F)C(=O)N[C@H](C(=O)NC1CCCC1)C

STK617949
Synonyms: (2Z)-2-(3,4-dimethoxybenzylidene)-7-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1ccc(c(c1)OC)OC)/C2=O

STK617950
Synonyms: N-(furan-2-ylmethyl)-11-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-amine
Smiles: CC1CCCc2c1c1c(s2)nc(n2c1ncn2)NCc1ccco1

STK617951
Synonyms: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-imino-4-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2,5-dihydro-1H-pyrrol-3-ol
Smiles: COc1ccc(cc1)c1csc(n1)C1=C(O)CN(C1=N)c1ccc2c(c1)OCCO2

STK617955
Synonyms: 1-(2-chlorobenzyl)-5-imino-4-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2,5-dihydro-1H-pyrrol-3-ol
Smiles: COc1ccc(cc1)c1csc(n1)C1=C(O)CN(C1=N)Cc1ccccc1Cl

STK617956
Synonyms: (4E)-4-{hydroxy[3-methyl-4-(propan-2-yloxy)phenyl]methylidene}-5-(4-hydroxyphenyl)-1-[2-(morpholin-4-yl)ethyl]pyrrolidine-2,3-dione
Smiles: CC(Oc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)O)CCN1CCOCC1)/O)C

STK617959
Synonyms: 6-(3-chloro-4-fluorophenyl)-3-(2-phenylethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: Fc1ccc(cc1Cl)c1nn2c(s1)nnc2CCc1ccccc1

STK617962
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(4-fluorophenyl)-1-[3-(morpholin-4-yl)propyl]pyrrolidine-2,3-dione
Smiles: Fc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1CCCN1CCOCC1

STK617964
Synonyms: {7-[4-(benzyloxy)phenyl]-2,5-dimethyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}(morpholin-4-yl)methanone
Smiles: CC1=C(C(=O)N2CCOCC2)C(n2c(=N1)[nH]c(n2)C)c1ccc(cc1)OCc1ccccc1

STK617965
Synonyms: N-[3-(5-chloro-1,3-benzoxazol-2-yl)-4-hydroxy-5-methylphenyl]-2-methyl-3-nitrobenzamide
Smiles: Clc1ccc2c(c1)nc(o2)c1cc(cc(c1O)C)NC(=O)c1cccc(c1C)[N+](=O)[O-]

STK617966
Synonyms: 4-(quinolin-5-yl)-5-(thiophen-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: S=c1[nH]nc(n1c1cccc2c1cccn2)c1cccs1

STK617967
Synonyms: 4-(4-hydroxy-3-methoxyphenyl)-3-methyl-7-phenyl-4,6,7,8-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5-ol
Smiles: COc1cc(ccc1O)C1C2=C(O)CC(CC2=Nc2c1c(C)no2)c1ccccc1

STK617968
Synonyms: (4E)-2-(3-methoxyphenyl)-4-({[2-methyl-2-(morpholin-4-yl)propyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: COc1cccc(c1)N1C(=O)/C(=C/NCC(N2CCOCC2)(C)C)/c2c(C1=O)cccc2

STK617970
Synonyms: N-(2,4-dimethylphenyl)-3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)CN(c1ccc(cc1C)C)C(=O)c1cc(OC)c(c(c1)OC)OC

STK617971
Synonyms: 7-methoxy-3-{(E)-[3-(2-methoxyphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}quinolin-2(1H)-one
Smiles: COc1ccc2c(c1)[nH]c(=O)c(c2)/C=C\1/SC(=S)N(C1=O)c1ccccc1OC

STK617973
Synonyms: N-(2,2-dimethoxyethyl)-2-[(9-oxo-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-7-yl)oxy]acetamide
Smiles: COC(CNC(=O)COc1ccc2c(c1)c(=O)n1c(n2)CCC1)OC

STK617974
Synonyms: N-{2-[(2-methoxyethyl)amino]-2-oxoethyl}-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Smiles: COCCNC(=O)CNC(=O)c1ccc2c(c1)sc(n2)n1cccc1

STK617975
Synonyms: 7-[2-(azepan-1-yl)-2-oxoethoxy]-3-(4-chlorophenyl)-4H-chromen-4-one
Smiles: Clc1ccc(cc1)c1coc2c(c1=O)ccc(c2)OCC(=O)N1CCCCCC1

STK617977
Synonyms: 2-(3,5-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)-N-(1H-1,2,4-triazol-3-yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)occ1C)Nc1n[nH]cn1

STK617979
Synonyms: ethyl3-(8-{[(1-benzylpiperidin-4-yl)amino]methyl}-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoate
Smiles: CCOC(=O)CCc1c(=O)oc2c(c1C)ccc(c2CNC1CCN(CC1)Cc1ccccc1)O

STK617983
Synonyms: N-{3-(1H-benzimidazol-2-yl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4,5-dimethyl-1H-pyrrol-2-yl}butanamide
Smiles: CCCC(=O)Nc1c(c2nc3c([nH]2)cccc3)c(c(n1CCc1ccc(c(c1)OC)OC)C)C

STK617985
Synonyms: N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N'-{2-[(2-phenylethyl)carbamoyl]phenyl}ethanediamide
Smiles: Cn1cc(c(n1)C)CNC(=O)C(=O)Nc1ccccc1C(=O)NCCc1ccccc1

STK617986
Synonyms: 5-(4,4-dimethyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-methoxy-N-methylbenzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)N(C1CCS(=O)(=O)C1)C)N1C(=O)C(CS1(=O)=O)(C)C

STK617987
Synonyms: N-(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)-N'-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]ethanediamide
Smiles: O=C(C(=O)NCc1c(C)nn(c1C)C)Nc1c(C)nn(c1C)Cc1ccccc1

STK617988
Synonyms: 3-(4-ethoxyphenoxy)-7-hydroxy-8-methyl-4H-chromen-4-one
Smiles: CCOc1ccc(cc1)Oc1coc2c(c1=O)ccc(c2C)O

STK617990
Synonyms: N-[4-(3-ethyl-2-hydroxy-6-oxo-3,4,5,6-tetrahydropyridin-3-yl)phenyl]-7-methoxy-1-benzofuran-2-carboxamide
Smiles: CCC1(CCC(=O)N=C1O)c1ccc(cc1)NC(=O)c1cc2c(o1)c(OC)ccc2

STK617991
Synonyms: 4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1-[2-(2-fluorophenyl)ethyl]-5-imino-2,5-dihydro-1H-pyrrol-3-ol
Smiles: Clc1ccc(cc1)c1csc(n1)C1=C(O)CN(C1=N)CCc1ccccc1F

STK617992
Synonyms: 2-(4-chlorophenyl)-N-(1,1-dioxido-2,3-dihydrothiophen-3-yl)acetamide
Smiles: O=C(Cc1ccc(cc1)Cl)NC1C=CS(=O)(=O)C1

STK617993
Synonyms: 1-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-3-(3-chlorophenyl)-1-methylurea
Smiles: Clc1cccc(c1)NC(=O)N(CC(=O)N1CCN(CC1)Cc1ccccc1)C

STK617994
Synonyms: N-{2-[(furan-2-ylmethyl)amino]-2-oxoethyl}-1-(phenylsulfonyl)piperidine-3-carboxamide
Smiles: O=C(NCc1ccco1)CNC(=O)C1CCCN(C1)S(=O)(=O)c1ccccc1

STK617996
Synonyms: N-[3,5-dimethyl-1-(2-methylbenzyl)-1H-pyrazol-4-yl]-N'-[2-(1H-indol-3-yl)ethyl]ethanediamide
Smiles: O=C(C(=O)NCCc1c[nH]c2c1cccc2)Nc1c(C)nn(c1C)Cc1ccccc1C

STK617997
Synonyms: N-[(2Z)-3-[4-(benzyloxy)phenyl]-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-cyanoacetamide
Smiles: N#CCC(=O)/N=C/1\SC2C(N1c1ccc(cc1)OCc1ccccc1)CS(=O)(=O)C2

STK617999
Synonyms: 3-(2-methoxy-2-oxoethyl)-4,7-dimethyl-2-oxo-6-(piperidinium-1-ylmethyl)-2H-chromen-5-olate
Smiles: COC(=O)Cc1c(=O)oc2c(c1C)c([O-])c(c(c2)C)C[NH+]1CCCCC1

STK618000
Synonyms: (2E)-2-(1,3-benzothiazol-2-yl)-3-(2-chloroquinolin-3-yl)prop-2-enenitrile
Smiles: N#C/C(=C\c1cc2ccccc2nc1Cl)/c1nc2c(s1)cccc2

STK618002
Synonyms: N~3~-(2-chloro-7H-purin-6-yl)-N-(1-phenylethyl)-beta-alaninamide
Smiles: O=C(NC(c1ccccc1)C)CCNc1nc(Cl)nc2c1[nH]cn2

STK618005
Synonyms: {2-[(2Z)-1,3-benzoxazol-2(3H)-ylideneamino]-4,6-dimethylpyrimidin-5-yl}(4-phenylpiperazin-1-yl)methanone
Smiles: Cc1nc(/N=c/2\oc3c([nH]2)cccc3)nc(c1C(=O)N1CCN(CC1)c1ccccc1)C

STK618007
Synonyms: 1-{[4-(acetylamino)phenyl]sulfonyl}-N-(pyridin-3-yl)piperidine-3-carboxamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)Nc1cccnc1

STK618008
Synonyms: 3-(1-{[4-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazin-1-yl]methyl}-1H-indol-3-yl)-1-(pyrrolidin-1-yl)propan-1-one
Smiles: O=C(C1COc2c(O1)cccc2)N1CCN(CC1)Cn1cc(c2c1cccc2)CCC(=O)N1CCCC1

STK618010
Synonyms: (6bS,9aR)-10-[(4-chlorophenyl)carbonyl]-3-fluoro-8-(prop-2-en-1-yl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: C=CCN1C(=O)[C@H]2[C@@H](C1=O)C(N1C2C=Cc2c1ccc(c2)F)C(=O)c1ccc(cc1)Cl

STK618012
Synonyms: 1-(1-benzylpiperidin-4-yl)-4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-5-imino-2,5-dihydro-1H-pyrrol-3-ol
Smiles: Clc1ccc(cc1)c1csc(n1)C1=C(O)CN(C1=N)C1CCN(CC1)Cc1ccccc1

STK618015
Synonyms: 5-(4-methoxyphenyl)-4-(pyridin-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1)c1n[nH]c(=S)n1c1cccnc1

STK618016
Synonyms: 10-[(2-chlorophenyl)carbonyl]-3-fluoro-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Fc1ccc2c(c1)C=CC1N2C(C2C1C(=O)NC2=O)C(=O)c1ccccc1Cl

STK618017
Synonyms: (4E)-4-[hydroxy(4-methoxyphenyl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-5-(pyridin-3-yl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)c1noc(c1)C)/O

STK618018
Synonyms: (2E)-2-[(1-ethyl-5-methoxy-1H-indol-3-yl)methylidene]-7-[(4-methylpiperidinium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C[NH+]1CCC(CC1)C)[O-])cn2CC

STK618019
Synonyms: (2Z)-7-{[bis(2-methylpropyl)ammonio]methyl}-3-oxo-2-(2,3,4-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: COc1c(ccc(c1OC)OC)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+](CC(C)C)CC(C)C)[O-]

STK618020
Synonyms: trans-4-({[(4-methylphenyl)sulfonyl]amino}methyl)-N-[2-(morpholin-4-yl)-2-oxoethyl]cyclohexanecarboxamide
Smiles: Cc1ccc(cc1)S(=O)(=O)NC[C@@H]1CC[C@H](CC1)C(=O)NCC(=O)N1CCOCC1

STK618024
Synonyms: ethyl3-{[(5-chloro-1-benzofuran-2-yl)carbonyl]amino}-5,6-dimethoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)c1cc3c(o1)ccc(c3)Cl)cc(c(c2)OC)OC

STK618026
Synonyms: 3-(4-chlorophenyl)-N-(2-methylpropyl)-4-[(phenylsulfonyl)amino]butanamide
Smiles: CC(CNC(=O)CC(c1ccc(cc1)Cl)CNS(=O)(=O)c1ccccc1)C

STK618028
Synonyms: 10,10-dimethyl-2-[3-(3-methylbutoxy)phenyl]-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-ol
Smiles: CC(CCOc1cccc(c1)c1nn2c(n1)c1c(nc2O)sc2c1CC(C)(C)OC2)C

STK618029
Synonyms: 10-acetyl-3-methoxy-8-(2-methoxy-5-nitrophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COc1ccc2c(c1)C=CC1N2C(C(=O)C)C2C1C(=O)N(C2=O)c1cc(ccc1OC)[N+](=O)[O-]

STK618030
Synonyms: N'-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(2-fluorophenyl)-1,3-oxazol-5-yl]-N,N-dimethylpropane-1,3-diamine
Smiles: CN(CCCNc1oc(nc1S(=O)(=O)c1ccc2c(c1)OCCO2)c1ccccc1F)C

STK618031
Synonyms: N,1,4-triphenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Smiles: S=C(c1n2cc(n3c2c(c1c1ccccc1)CCCC3)c1ccccc1)Nc1ccccc1

STK618032
Synonyms: (2E)-7-(azepanium-1-ylmethyl)-2-[(1-methyl-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: O=C1/C(=C\c2cn(c3c2cccc3)C)/Oc2c1ccc(c2C[NH+]1CCCCCC1)[O-]

STK618033
Synonyms: (4E)-5-(4-ethoxyphenyl)-4-[hydroxy(thiophen-2-yl)methylidene]-1-[2-(morpholin-4-yl)ethyl]pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2cccs2)\O)/C(=O)C(=O)N1CCN1CCOCC1

STK618035
Synonyms: methyl3-{(E)-[3-(2-methoxyphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1/C=C\1/SC(=S)N(C1=O)c1ccccc1OC)cccc2

STK618036
Synonyms: 2-{[3-(2-ethoxyphenoxy)-2-methyl-4-oxo-4H-chromen-7-yl]oxy}-N-(2-methylphenyl)acetamide
Smiles: CCOc1ccccc1Oc1c(C)oc2c(c1=O)ccc(c2)OCC(=O)Nc1ccccc1C

STK618038
Synonyms: (4E)-1-[2-(dimethylamino)ethyl]-4-[hydroxy(3-methoxyphenyl)methylidene]-5-(2-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1OC)CCN(C)C)/O

STK618039
Synonyms: 2,3,5-trimethyl-6-(2-oxo-2-{4-[2-(pyridin-4-yl)ethyl]piperazin-1-yl}ethyl)-7H-furo[3,2-g]chromen-7-one
Smiles: O=C(N1CCN(CC1)CCc1ccncc1)Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C

STK618040
Synonyms: (2E)-2-[(methylsulfonyl)imino]-N-(pyridin-4-ylmethyl)-2,3-dihydro-1,3-benzothiazole-6-carboxamide
Smiles: O=C(c1ccc2c(c1)s/c(=N/S(=O)(=O)C)/[nH]2)NCc1ccncc1

STK618041
Synonyms: 3-chloro-N-[1-(1,1-dioxidotetrahydrothiophen-3-yl)-3-phenyl-1H-pyrazol-5-yl]benzenesulfonamide
Smiles: Clc1cccc(c1)S(=O)(=O)Nc1cc(nn1C1CCS(=O)(=O)C1)c1ccccc1

STK618043
Synonyms: N-{1-[(2,5-dimethylphenyl)amino]-4-(methylsulfanyl)-1-oxobutan-2-yl}-3-hydroxyquinoxaline-1(2H)-carboxamide
Smiles: CSCCC(C(=O)Nc1cc(C)ccc1C)NC(=O)N1CC(=Nc2c1cccc2)O

STK618045
Synonyms: methyl1-[oxo(quinolin-5-ylamino)acetyl]piperidine-4-carboxylate
Smiles: COC(=O)C1CCN(CC1)C(=O)C(=O)Nc1cccc2c1cccn2

STK618046
Synonyms: 2-[(8-ethoxy-4-methylquinazolin-2-yl)amino]quinazolin-4-ol
Smiles: CCOc1cccc2c1nc(Nc1nc(O)c3c(n1)cccc3)nc2C

STK618047
Synonyms: 2-[3-(4-chlorophenyl)-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]-N-[2-(dimethylamino)ethyl]acetamide
Smiles: CN(CCNC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1c1ccc(cc1)Cl)C

STK618048
Synonyms: 2-[(2-chlorobenzyl)oxy]-7,8,9,10-tetrahydroazepino[2,1-b]quinazolin-12(6H)-one
Smiles: Clc1ccccc1COc1ccc2c(c1)c(=O)n1c(n2)CCCCC1

STK618049
Synonyms: 4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-phenyl-1,3-oxazol-5-yl]morpholine
Smiles: O=S(=O)(c1nc(oc1N1CCOCC1)c1ccccc1)c1ccc2c(c1)OCCO2

STK618050
Synonyms: 2-chloro-N-(3,4-dimethoxybenzyl)-N-{3-phenyl-3-[4-(propan-2-yloxy)phenyl]propyl}acetamide
Smiles: ClCC(=O)N(Cc1ccc(c(c1)OC)OC)CCC(c1ccc(cc1)OC(C)C)c1ccccc1

STK618051
Synonyms: N-(2-methoxybenzyl)-N'-(2-methoxydibenzo[b,d]furan-3-yl)ethanediamide
Smiles: COc1cc2c(cc1NC(=O)C(=O)NCc1ccccc1OC)oc1c2cccc1

STK618055
Synonyms: (4E)-5-(2,3-dimethoxyphenyl)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Smiles: COCCCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)C)OC)/O)/C1c1cccc(c1OC)OC

STK618058
Synonyms: 10-acetyl-3-methoxy-8-(2-methyl-5-nitrophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COc1ccc2c(c1)C=CC1N2C(C(=O)C)C2C1C(=O)N(C2=O)c1cc(ccc1C)[N+](=O)[O-]

STK618059
Synonyms: N~2~-(2-chloro-7H-purin-6-yl)-N-(4-phenoxyphenyl)glycinamide
Smiles: O=C(Nc1ccc(cc1)Oc1ccccc1)CNc1nc(Cl)nc2c1[nH]cn2

STK618061
Synonyms: 2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]-N-[2-(4-methoxyphenyl)ethyl]acetamide
Smiles: COc1ccc(cc1)CCNC(=O)Cc1csc(n1)c1ccc(c(c1)OC)OC

STK618062
Synonyms: 5-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: Nc1nnc(s1)SCc1cc(O)n2c(n1)ncn2

STK618063
Synonyms: (2Z)-7-[(dibutylammonio)methyl]-2-(3,4-dichlorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1ccc(c(c1)Cl)Cl)/C2=O)CCCC

STK618064
Synonyms: N-[2-(3,4-dihydroxyphenyl)ethyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide
Smiles: COc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)NCCc1ccc(c(c1)O)O

STK618065
Synonyms: methyl(3-{(E)-[1-(3-bromophenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}-1H-indol-1-yl)acetate
Smiles: COC(=O)Cn1cc(c2c1cccc2)/C=C/1\C(=NC(=O)N(C1=O)c1cccc(c1)Br)O

STK618067
Synonyms: ethyl4-(2-methoxyphenyl)-6-oxo-2-(4-phenylpiperazin-1-yl)-1,4,5,6-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1C(=O)NC(=NC1c1ccccc1OC)N1CCN(CC1)c1ccccc1

STK618070
Synonyms: 4-(2-hydroxyethyl)-5-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: OCCn1c(n[nH]c1=S)c1ccccc1

STK618071
Synonyms: N-[2-(furan-2-yl)-2-(pyrrolidin-1-yl)ethyl]-3,6-dimethyl-1-benzofuran-2-carboxamide
Smiles: Cc1ccc2c(c1)oc(c2C)C(=O)NCC(c1ccco1)N1CCCC1

STK618073
Synonyms: N-[2-(dimethylamino)ethyl]-2-[(5Z)-5-(2-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetamide
Smiles: COc1ccccc1/C=C/1\SC(=S)N(C1=O)CC(=O)NCCN(C)C

STK618074
Synonyms: methyl1-({4-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)methyl]cyclohexyl}carbonyl)piperidine-4-carboxylate
Smiles: COC(=O)C1CCN(CC1)C(=O)C1CCC(CC1)Cn1nnc2c(c1=O)cccc2

STK618075
Synonyms: (5E)-3-(3-chloro-4-methoxyphenyl)-5-{[1-(4-fluorobenzyl)-1H-pyrrol-2-yl]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1Cl)N1C(=O)N=C(/C(=C\c2cccn2Cc2ccc(cc2)F)/C1=O)O

STK618077
Synonyms: (3E)-1-(4-fluorophenyl)-3-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methylidene]pyrrolidine-2,5-dione
Smiles: Fc1ccc(cc1)N1C(=O)C/C(=C\c2c(C)nn(c2C)C)/C1=O

STK618079
Synonyms: 1-[(4-fluorophenyl)sulfonyl]-N-{(2S)-1-oxo-1-[(pyridin-4-ylmethyl)amino]propan-2-yl}piperidine-3-carboxamide
Smiles: O=C([C@@H](NC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)F)C)NCc1ccncc1

STK618082
Synonyms: (4E)-4-[hydroxy(5-methylfuran-2-yl)methylidene]-5-(4-hydroxyphenyl)-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Smiles: COCCCN1C(=O)C(=O)/C(=C(\c2ccc(o2)C)/O)/C1c1ccc(cc1)O

STK618084
Synonyms: N-cyclohexyl-4-hydroxy-6-oxo-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinoline-5-carboxamide
Smiles: O=C(c1c(O)n2CCc3c2c(c1=O)ccc3)NC1CCCCC1

STK618087
Synonyms: [4-(3-chlorophenyl)piperazin-1-yl][2-(3,4-dimethoxyphenyl)-4-methyl-1,3-thiazol-5-yl]methanone
Smiles: COc1cc(ccc1OC)c1nc(c(s1)C(=O)N1CCN(CC1)c1cccc(c1)Cl)C

STK618089
Synonyms: (4E)-4-{[4-(benzyloxy)-2-methylphenyl](hydroxy)methylidene}-1-(pyridin-3-ylmethyl)-5-(thiophen-2-yl)pyrrolidine-2,3-dione
Smiles: Cc1cc(OCc2ccccc2)ccc1/C(=C\1/C(c2cccs2)N(C(=O)C1=O)Cc1cccnc1)/O

STK618093
Synonyms: 5-(4,4-dimethyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)-2-methoxy-N-[2-(4-methoxyphenoxy)ethyl]benzenesulfonamide
Smiles: COc1ccc(cc1)OCCNS(=O)(=O)c1cc(ccc1OC)N1C(=O)C(CS1(=O)=O)(C)C

STK618094
Synonyms: N-(3-fluorophenyl)-2-[(9-oxo-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-7-yl)oxy]acetamide
Smiles: O=C(Nc1cccc(c1)F)COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK618095
Synonyms: 1-[(4-fluorophenyl)sulfonyl]-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]piperidine-4-carboxamide
Smiles: O=C(Nc1cccnc1)CNC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)F

STK618096
Synonyms: 2-[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)oxy]-N-phenylacetamide
Smiles: O=C(Nc1ccccc1)COc1ccc2c(c1)c(=O)n1c(n2)CCCCC1

STK618097
Synonyms: N-cyclopropyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(2-nitrophenyl)-1,3-oxazol-5-amine
Smiles: [O-][N+](=O)c1ccccc1c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)NC1CC1

STK618101
Synonyms: 1-[(4-methoxyphenyl)sulfonyl]-N-{2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl}piperidine-3-carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)NCC(=O)Nc1ncc(s1)C

STK618105
Synonyms: (E)-{1-[2-(dimethylammonio)ethyl]-2-(4-hydroxy-3-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(phenyl)methanolate
Smiles: COc1cc(ccc1O)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1CC[NH+](C)C

STK618109
Synonyms: N-[6-chloro-3-(3-methoxyphenyl)-4-oxo-4H-chromen-2-yl]-2-(2,6-dimethylmorpholin-4-yl)acetamide
Smiles: COc1cccc(c1)c1c(NC(=O)CN2CC(C)OC(C2)C)oc2c(c1=O)cc(cc2)Cl

STK618110
Synonyms: (2Z)-7-(azepanium-1-ylmethyl)-2-[(5-bromo-1-benzofuran-2-yl)methylidene]-4-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: Brc1ccc2c(c1)cc(o2)/C=C/1\Oc2c(C1=O)c(C)cc(c2C[NH+]1CCCCCC1)[O-]

STK618111
Synonyms: N-[(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl]-1-(4-fluorophenyl)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carboxamide
Smiles: COc1cc2c(cc1OC)CCN(C2c1ccc(cc1)F)C(=O)N[C@H](C(=O)NC1CC1)C

STK618112
Synonyms: 6-methyl-5-(prop-2-en-1-yl)-2-[4-(pyridin-2-yl)piperazin-1-yl]pyrimidin-4-ol
Smiles: C=CCc1c(C)nc(nc1O)N1CCN(CC1)c1ccccn1

STK618113
Synonyms: (2E)-7-{[benzyl(methyl)ammonio]methyl}-2-[(5-methoxy-1-methyl-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C[NH+](Cc1ccccc1)C)[O-])cn2C

STK618115
Synonyms: 4-(4,5-dimethyl-1,3-thiazol-2-yl)-1-(3,3-diphenylpropyl)-5-imino-2,5-dihydro-1H-pyrrol-3-ol
Smiles: OC1=C(c2sc(c(n2)C)C)C(=N)N(C1)CCC(c1ccccc1)c1ccccc1

STK618116
Synonyms: 2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxo-N-[2-(pyrrolidin-1-ylcarbonyl)phenyl]acetamide
Smiles: Clc1ccc(cc1)C1(O)CCN(CC1)C(=O)C(=O)Nc1ccccc1C(=O)N1CCCC1

STK618118
Synonyms: 5-(4,4-dimethyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)-2-methoxy-N-(2-methoxybenzyl)benzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)NCc1ccccc1OC)N1C(=O)C(CS1(=O)=O)(C)C

STK618124
Synonyms: ethyl3-(7-hydroxy-4-methyl-8-{[(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)amino]methyl}-2-oxo-2H-chromen-3-yl)propanoate
Smiles: CCOC(=O)CCc1c(=O)oc2c(c1C)ccc(c2CNC1(C)CCS(=O)(=O)C1)O

STK618125
Synonyms: 6-chloro-7-methoxy-4-methyl-3-[2-oxo-2-(1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl)ethyl]-2H-chromen-2-one
Smiles: COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)N1CCc2c(C1)nc[nH]2

STK618127
Synonyms: 2-{[3-(4-chlorophenyl)-2-methyl-4-oxo-4H-chromen-7-yl]oxy}-N-(2,4-dimethoxyphenyl)acetamide
Smiles: COc1cc(OC)ccc1NC(=O)COc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)Cl)C

STK618128
Synonyms: N-(3-chlorophenyl)-4-[2-(morpholin-4-yl)-2-oxoethyl]piperazine-1-carboxamide
Smiles: Clc1cccc(c1)NC(=O)N1CCN(CC1)CC(=O)N1CCOCC1

STK618131
Synonyms: (4E)-4-{hydroxy[2-methyl-4-(2-methylpropoxy)phenyl]methylidene}-5-(4-hydroxyphenyl)-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Smiles: COCCCN1C(c2ccc(cc2)O)/C(=C(/c2ccc(cc2C)OCC(C)C)\O)/C(=O)C1=O

STK618134
Synonyms: 3,3-dimethyl-6-{4-[oxo(pyrrolidin-1-yl)acetyl]piperazin-1-yl}-8-phenyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: N#Cc1c(nc(c2c1CC(C)(C)OC2)c1ccccc1)N1CCN(CC1)C(=O)C(=O)N1CCCC1

STK618136
Synonyms: 5-(4-bromophenyl)-4-(pyridin-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Brc1ccc(cc1)c1n[nH]c(=S)n1c1cccnc1

STK618137
Synonyms: 5-butyl-6-methyl-2-[(4-methylquinazolin-2-yl)amino]pyrimidin-4-ol
Smiles: CCCCc1c(C)nc(nc1O)Nc1nc(C)c2c(n1)cccc2

STK618138
Synonyms: (4E)-5-(4-ethoxyphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(4-methoxyphenyl)methylidene]pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)OC)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)CC

STK618139
Synonyms: N-(4-butylphenyl)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
Smiles: CCCCc1ccc(cc1)NC(=O)c1nn(c2c1CCCC2)C1CCS(=O)(=O)C1

STK618141
Synonyms: 3-{2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxoethyl}-4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2H-chromen-2-one
Smiles: OCCN1CCN(CC1)C(=O)Cc1c(=O)oc2c(c1C)ccc(c2)OCC(=C)C

STK618143
Synonyms: (2Z)-7-[(dipropylammonio)methyl]-2-(1H-indol-3-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1c[nH]c3c1cccc3)/C2=O)CCC

STK618144
Synonyms: (4E)-5-(4-tert-butylphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(4-methylphenyl)methylidene]pyrrolidine-2,3-dione
Smiles: CCc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)C(C)(C)C)/C(=C(/c2ccc(cc2)C)\O)/C(=O)C1=O

STK618145
Synonyms: 7-[2-(4-benzylpiperazin-1-yl)-2-oxoethoxy]-2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-one
Smiles: O=C(N1CCN(CC1)Cc1ccccc1)COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK618147
Synonyms: 2-chloro-3-hydroxy-4-[(pyridin-3-ylamino)methyl]-7,8,9,10-tetrahydro-6H-benzo[c]chromen-6-one
Smiles: Clc1cc2c(c(c1O)CNc1cccnc1)oc(=O)c1c2CCCC1

STK618148
Synonyms: 1-(4-{4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butoxy}-3-methoxyphenyl)ethanone
Smiles: COc1cc(ccc1OCCCCN1CCN(CC1)c1nsc2c1cccc2)C(=O)C

STK618150
Synonyms: 8-[2-(dimethylamino)ethyl]-1,7-dimethyl-3-(2-phenylethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CN(CCn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCc1ccccc1)C

STK618152
Synonyms: N-[4-(acetylamino)phenyl]-2-{[3-(4-chlorophenyl)-4-oxo-4H-chromen-7-yl]oxy}acetamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)COc1ccc2c(c1)occ(c2=O)c1ccc(cc1)Cl

STK618153
Synonyms: 4-(4-chlorophenyl)-5-(3,5-dimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(OC)cc(c1)c1n[nH]c(=S)n1c1ccc(cc1)Cl

STK618154
Synonyms: ethyl4-({(2E)-2-[(methylsulfonyl)imino]-2,3-dihydro-1,3-benzothiazol-6-yl}carbonyl)piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)c1ccc2c(c1)s/c(=N/S(=O)(=O)C)/[nH]2

STK618157
Synonyms: [1-(5-nitropyridin-2-yl)piperidin-4-yl](thiomorpholin-4-yl)methanone
Smiles: O=C(N1CCSCC1)C1CCN(CC1)c1ccc(cn1)[N+](=O)[O-]

STK618158
Synonyms: 4-butyl-8-[(dimethylammonio)methyl]-2-oxo-2H-chromen-7-olate
Smiles: CCCCc1cc(=O)oc2c1ccc(c2C[NH+](C)C)[O-]

STK618161
Synonyms: (4E)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(4-methylphenyl)methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Smiles: CCc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)[N+](=O)[O-])/C(=C(/c2ccc(cc2)C)\O)/C(=O)C1=O

STK618162
Synonyms: 2-(4-{[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl}phenyl)-4,4-dimethyl-1,2-thiazolidin-3-one1,1-dioxide
Smiles: Clc1cccc(c1)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)N1C(=O)C(CS1(=O)=O)(C)C

STK618165
Synonyms: (4E)-5-(2,3-dimethoxyphenyl)-4-[hydroxy(phenyl)methylidene]-1-[3-(morpholin-4-yl)propyl]pyrrolidine-2,3-dione
Smiles: COc1c(OC)cccc1C1N(CCCN2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccccc1)/O

STK618167
Synonyms: methyl2-{(3E)-2-(4-bromophenyl)-3-[hydroxy(3-methoxyphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: COc1cccc(c1)/C(=C\1/C(c2ccc(cc2)Br)N(C(=O)C1=O)c1sc(c(n1)C)C(=O)OC)/O

STK618169
Synonyms: 2-[(3-chloro-2,5,6-trifluoropyridin-4-yl)sulfonyl]ethanol
Smiles: OCCS(=O)(=O)c1c(F)c(F)nc(c1Cl)F

STK618170
Synonyms: N-[(2S)-1-(4-benzylpiperazin-1-yl)-1-oxopropan-2-yl]-5-ethyl-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Smiles: CCn1cc(C(=O)N[C@H](C(=O)N2CCN(CC2)Cc2ccccc2)C)c(=O)c2c1cc1OCOc1c2

STK618173
Synonyms: trans-N-[2-(cyclopentylamino)-2-oxoethyl]-4-({[(4-fluorophenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide
Smiles: O=C(NC1CCCC1)CNC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)F

STK618176
Synonyms: 5-(4-methylphenyl)-4-(quinolin-5-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1ccc(cc1)c1n[nH]c(=S)n1c1cccc2c1cccn2

STK618177
Synonyms: 4-hydroxy-8-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-1,7-dimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: COc1ccc(cc1)N1CCN(CC1)CCCn1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK618179
Synonyms: N-[(2E)-4-methyl-1,3-thiazol-2(3H)-ylidene]-2-[(9-oxo-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-7-yl)oxy]acetamide
Smiles: O=C(/N=c\1/scc([nH]1)C)COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK618181
Synonyms: 6-ethyl-6-methyl-4-(2-phenylethyl)-1-sulfanyl-6,7-dihydrobenzo[h]imidazo[1,2-a]quinazolin-5(4H)-one
Smiles: CCC1(C)Cc2ccccc2c2c1c(=O)n(c1n2c(S)cn1)CCc1ccccc1

STK618182
Synonyms: 3-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-7-methoxy-4-methyl-2H-chromen-2-one
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CC(=O)N1CCN(CC1)c1ccccc1F

STK618183
Synonyms: 1-[(4-chlorophenyl)sulfonyl]-N-{2-oxo-2-[(pyridin-2-ylmethyl)amino]ethyl}piperidine-3-carboxamide
Smiles: O=C(NCc1ccccn1)CNC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)Cl

STK618184
Synonyms: N-[3-(cyclopropylamino)-3-oxopropyl]-1-[(4-methoxyphenyl)sulfonyl]piperidine-3-carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)NCCC(=O)NC1CC1

STK618187
Synonyms: N-(3-chlorophenyl)-2-(7H-purin-6-ylsulfanyl)propanamide
Smiles: O=C(C(Sc1ncnc2c1[nH]cn2)C)Nc1cccc(c1)Cl

STK618191
Synonyms: N-(2-chlorophenyl)-N~2~-[(4-hydroxyphthalazin-1-yl)acetyl]alaninamide
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NC(C(=O)Nc1ccccc1Cl)C

STK618194
Synonyms: N-[2-(4-hydroxyphenyl)ethyl]-N'-{2-[(pyridin-3-ylmethyl)carbamoyl]phenyl}ethanediamide
Smiles: Oc1ccc(cc1)CCNC(=O)C(=O)Nc1ccccc1C(=O)NCc1cccnc1

STK618195
Synonyms: N-[2-(4-sulfamoylphenyl)ethyl]-2-[2-(3,4,5-trimethoxyphenyl)-1,3-thiazol-4-yl]acetamide
Smiles: COc1cc(cc(c1OC)OC)c1scc(n1)CC(=O)NCCc1ccc(cc1)S(=O)(=O)N

STK618199
Synonyms: N-[4-({2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}sulfamoyl)phenyl]acetamide
Smiles: COc1cc(NS(=O)(=O)c2ccc(cc2)NC(=O)C)c(cc1OC)Cc1nccc2c1cc(OC)c(c2)OC

STK618202
Synonyms: N-cyclooctyl-3-[(4S)-1-{[4-(4-methoxyphenyl)tetrahydro-2H-pyran-4-yl]methyl}-2,5-dioxoimidazolidin-4-yl]propanamide
Smiles: COc1ccc(cc1)C1(CCOCC1)CN1C(=O)N[C@H](C1=O)CCC(=O)NC1CCCCCCC1

STK618204
Synonyms: (5Z)-5-(3,4-dihydroxybenzylidene)-6-hydroxy-3-[4-(propan-2-yl)phenyl]pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C/c2ccc(c(c2)O)O)/C(=O)N1c1ccc(cc1)C(C)C

STK618205
Synonyms: 1-(4-methylphenyl)tetrahydro-1H-thieno[3,4-d]imidazole-2(3H)-thione5,5-dioxide
Smiles: S=C1NC2C(N1c1ccc(cc1)C)CS(=O)(=O)C2

STK618206
Synonyms: 1-(1-benzylpiperidin-4-yl)-4-(4,5-dimethyl-1,3-thiazol-2-yl)-5-imino-2,5-dihydro-1H-pyrrol-3-ol
Smiles: OC1=C(c2sc(c(n2)C)C)C(=N)N(C1)C1CCN(CC1)Cc1ccccc1

STK618207
Synonyms: 5-amino-N-(2-chlorobenzyl)-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide
Smiles: CSc1cccc(c1)n1nnc(c1N)C(=O)NCc1ccccc1Cl

STK618210
Synonyms: 3-ethyl-8,8-dimethyl-2-sulfanyl-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: CCn1c(S)nc2c(c1=O)cc1c(n2)CC(OC1)(C)C

STK618211
Synonyms: (E)-{1-[2-(dimethylammonio)ethyl]-2-(4-hydroxy-3-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}[3-methyl-4-(2-methylpropoxy)phenyl]methanolate
Smiles: COc1cc(ccc1O)C1N(CC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1ccc(c(c1)C)OCC(C)C)/[O-]

STK618212
Synonyms: 5-(3-hydroxyphenyl)-4-(pyridin-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Oc1cccc(c1)c1n[nH]c(=S)n1c1cccnc1

STK618213
Synonyms: 2-[(2-cyanobenzyl)sulfanyl]-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile
Smiles: N#Cc1c(SCc2ccccc2C#N)nc(cc1C(F)(F)F)C

STK618214
Synonyms: 1-(3-bromophenyl)-5-imino-4-(4-phenyl-1,3-thiazol-2-yl)-2,5-dihydro-1H-pyrrol-3-ol
Smiles: Brc1cccc(c1)N1CC(=C(C1=N)c1scc(n1)c1ccccc1)O

STK618216
Synonyms: (4E)-4-[({[1-(dimethylamino)cyclohexyl]methyl}amino)methylidene]-2-(4-methoxyphenyl)isoquinoline-1,3(2H,4H)-dione
Smiles: COc1ccc(cc1)N1C(=O)/C(=C/NCC2(CCCCC2)N(C)C)/c2c(C1=O)cccc2

STK618218
Synonyms: 3-methyl-1-[2-(morpholin-4-yl)ethyl]-1-(naphthalen-1-ylmethyl)thiourea
Smiles: CNC(=S)N(Cc1cccc2c1cccc2)CCN1CCOCC1

STK618221
Synonyms: N-[2-(furan-2-yl)ethyl]-2-[(9-oxo-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-7-yl)oxy]acetamide
Smiles: O=C(COc1ccc2c(c1)c(=O)n1c(n2)CCC1)NCCc1ccco1

STK618222
Synonyms: 2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-(pyridin-3-ylmethyl)acetamide
Smiles: COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)NCc1cccnc1

STK618223
Synonyms: 3-[(E)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-7-methoxyquinolin-2(1H)-one
Smiles: COc1ccc2c(c1)[nH]c(=O)c(c2)/C=C\1/SC(=S)N(C1=O)Cc1ccccc1

STK618224
Synonyms: 5-(4,4-dimethyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)-2-methoxy-N-(4-methoxyphenyl)benzenesulfonamide
Smiles: COc1ccc(cc1)NS(=O)(=O)c1cc(ccc1OC)N1C(=O)C(CS1(=O)=O)(C)C

STK618225
Synonyms: 4-(4-bromophenyl)-N,1-diphenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Smiles: Brc1ccc(cc1)c1c2CCCCn3c2n(c1C(=S)Nc1ccccc1)nc3c1ccccc1

STK618226
Synonyms: N-(3-chlorophenyl)-2-{[5-cyano-3,3-dimethyl-8-(piperazin-1-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-6-yl]sulfanyl}acetamide
Smiles: N#Cc1c(SCC(=O)Nc2cccc(c2)Cl)nc(c2c1CC(C)(C)OC2)N1CCNCC1

STK618227
Synonyms: methyl{(2Z)-4-phenyl-2-[(3-phenylpropanoyl)imino]-2,3-dihydro-1,3-thiazol-5-yl}carbamate
Smiles: COC(=O)Nc1s/c(=N\C(=O)CCc2ccccc2)/[nH]c1c1ccccc1

STK618228
Synonyms: methyl2-[(3E)-3-[hydroxy(4-methoxyphenyl)methylidene]-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccc(cc2)OC)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)OC

STK618229
Synonyms: 3-[3-(4-bromophenyl)-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]propanoicacid
Smiles: OC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1c1ccc(cc1)Br

STK618231
Synonyms: (2E)-N-(6-methylpyridin-2-yl)-2-[(methylsulfonyl)imino]-2,3-dihydro-1,3-benzothiazole-6-carboxamide
Smiles: Cc1cccc(n1)NC(=O)c1ccc2c(c1)s/c(=N/S(=O)(=O)C)/[nH]2

STK618232
Synonyms: (2E)-2-(1,3-benzoxazol-2-yl)-3-(2-nitrophenyl)-1-(4-propoxyphenyl)prop-2-en-1-one
Smiles: CCCOc1ccc(cc1)C(=O)/C(=C/c1ccccc1[N+](=O)[O-])/c1nc2c(o1)cccc2

STK618233
Synonyms: N-[(2Z)-5-[(3,5-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]-2-(4-fluorophenoxy)acetamide
Smiles: Fc1ccc(cc1)OCC(=O)/N=c\1/[nH]nc(s1)COc1cc(C)cc(c1)C

STK618236
Synonyms: trans-N-{2-[(2-fluorophenyl)amino]-2-oxoethyl}-4-{[(phenylsulfonyl)amino]methyl}cyclohexanecarboxamide
Smiles: O=C(Nc1ccccc1F)CNC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccccc1

STK618237
Synonyms: N-(3-fluorophenyl)-2-(7H-purin-6-ylsulfanyl)propanamide
Smiles: O=C(C(Sc1ncnc2c1[nH]cn2)C)Nc1cccc(c1)F

STK618243
Synonyms: (4E)-1-[3-(diethylamino)propyl]-4-[(4-fluorophenyl)(hydroxy)methylidene]-5-(pyridin-2-yl)pyrrolidine-2,3-dione
Smiles: CCN(CCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)F)/O)/C1c1ccccn1)CC

STK618244
Synonyms: N-(propan-2-yl)-N'-{2-[(pyridin-2-ylmethyl)carbamoyl]phenyl}ethanediamide
Smiles: CC(NC(=O)C(=O)Nc1ccccc1C(=O)NCc1ccccn1)C

STK618248
Synonyms: 6-amino-5-[6-(5-chlorothiophen-2-yl)-4-hydroxy-2-oxo-2,7-dihydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]pyrimidine-2,4(1H,3H)-dione
Smiles: Clc1ccc(s1)c1[nH]c2c(c1c1c(N)[nH]c(=O)[nH]c1=O)c(O)nc(=O)[nH]2

STK618250
Synonyms: N-[2-(6-ethyl-2-oxo-2H-chromen-4-yl)-1-benzofuran-3-yl]-4-fluorobenzamide
Smiles: CCc1ccc2c(c1)c(cc(=O)o2)c1oc2c(c1NC(=O)c1ccc(cc1)F)cccc2

STK618251
Synonyms: methyl{3-[3-(furan-2-yl)propyl]-6,10-dimethyl-8-oxo-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-7-yl}acetate
Smiles: COC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)OCN(C1)CCCc1ccco1

STK618252
Synonyms: 1-[(4-fluorophenyl)sulfonyl]-N-[(2S)-4-(methylsulfanyl)-1-oxo-1-(pyrrolidin-1-yl)butan-2-yl]piperidine-4-carboxamide
Smiles: CSCC[C@@H](C(=O)N1CCCC1)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)F

STK618254
Synonyms: N-[2-(2-hydroxyethoxy)ethyl]-1-(7H-purin-6-yl)piperidine-3-carboxamide
Smiles: OCCOCCNC(=O)C1CCCN(C1)c1ncnc2c1[nH]cn2

STK618256
Synonyms: N-[3-(dimethylamino)propyl]-2-(4-hydroxyphthalazin-1-yl)acetamide
Smiles: CN(CCCNC(=O)Cc1nnc(c2c1cccc2)O)C

STK618259
Synonyms: 2-[(2-chloro-7H-purin-6-yl)sulfanyl]-N-(pyridin-3-ylmethyl)propanamide
Smiles: O=C(C(Sc1nc(Cl)nc2c1[nH]cn2)C)NCc1cccnc1

STK618260
Synonyms: 3-(3-chloro-4-fluorophenyl)-6-[4-(prop-2-en-1-yloxy)phenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: C=CCOc1ccc(cc1)c1nn2c(s1)nnc2c1ccc(c(c1)Cl)F

STK618262
Synonyms: 5-amino-1-(3-bromophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-1H-1,2,3-triazole-4-carboxamide
Smiles: COc1cc(CCNC(=O)c2nnn(c2N)c2cccc(c2)Br)ccc1OC

STK618263
Synonyms: N-[(5Z)-4-oxo-5-(quinolin-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]pyridine-3-carboxamide
Smiles: O=C(c1cccnc1)NN1C(=S)S/C(=C\c2ccc3c(n2)cccc3)/C1=O

STK618264
Synonyms: (4E)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(phenyl)methylidene]-5-(2-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccccc1C1N(c2nc3c(s2)cc(cc3)CC)C(=O)C(=O)/C/1=C(\c1ccccc1)/O

STK618265
Synonyms: 3-[(4S)-1-benzyl-2,5-dioxoimidazolidin-4-yl]-N-[2-(dimethylamino)ethyl]propanamide
Smiles: CN(CCNC(=O)CC[C@@H]1NC(=O)N(C1=O)Cc1ccccc1)C

STK618266
Synonyms: [1-hydroxy-11-(3-methoxyphenyl)-3,3-dimethyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl](phenyl)methanone
Smiles: COc1cccc(c1)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)c1ccccc1)cccc2)(C)C

STK618271
Synonyms: N-(3-hydroxyphenyl)-6-oxo-1-phenyl-1,4,5,6-tetrahydropyridazine-3-carboxamide
Smiles: Oc1cccc(c1)NC(=O)C1=NN(C(=O)CC1)c1ccccc1

STK618273
Synonyms: 2-{4-[(4-ethyl-2-oxo-2H-chromen-7-yl)oxy]-3-oxobutyl}-1H-isoindole-1,3(2H)-dione
Smiles: CCc1cc(=O)oc2c1ccc(c2)OCC(=O)CCN1C(=O)c2c(C1=O)cccc2

STK618274
Synonyms: methyl(2Z)-2-[(phenoxyacetyl)imino]-2,3-dihydro-1,3-benzothiazole-6-carboxylate
Smiles: COC(=O)c1ccc2c(c1)s/c(=N\C(=O)COc1ccccc1)/[nH]2

STK618276
Synonyms: 2-methyl-4-(4-methyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)-N-(3,4,5-trimethoxyphenyl)benzenesulfonamide
Smiles: COc1cc(cc(c1OC)OC)NS(=O)(=O)c1ccc(cc1C)N1C(=O)C(CS1(=O)=O)C

STK618277
Synonyms: 4-methyl-N-(6-methylpyridin-2-yl)-2-phenyl-1,3-thiazole-5-carboxamide
Smiles: Cc1cccc(n1)NC(=O)c1sc(nc1C)c1ccccc1

STK618281
Synonyms: 1-(4-methoxyphenyl)-2-phenyl-1H-imidazo[4,5-b]quinoxaline
Smiles: COc1ccc(cc1)n1c(nc2c1nc1ccccc1n2)c1ccccc1

STK618282
Synonyms: 4-[2-(morpholin-4-yl)ethyl]-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1CCN1CCOCC1

STK618285
Synonyms: 1-(4-benzylpiperazin-1-yl)-2-(4-hydroxyphthalazin-1-yl)ethanone
Smiles: O=C(N1CCN(CC1)Cc1ccccc1)Cc1nnc(c2c1cccc2)O

STK618286
Synonyms: N-(3-phenylpropyl)-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Smiles: O=C(c1ccc2c(c1)sc(n2)n1cccc1)NCCCc1ccccc1

STK618287
Synonyms: 2-hydroxy-1-(2-methoxyethyl)-5-(3-nitrophenyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Smiles: COCCn1c(O)nc(=O)c2c1nccc2c1cccc(c1)[N+](=O)[O-]

STK618288
Synonyms: 3-bromo-8-butyl-10-(phenylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: CCCCN1C(=O)C2C(C1=O)C(N1C2C=Cc2c1ccc(c2)Br)C(=O)c1ccccc1

STK618289
Synonyms: 1-[(4-methoxyphenyl)sulfonyl]-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]piperidine-3-carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)NCC(=O)Nc1ccccn1

STK618291
Synonyms: 5-amino-1-(4-methylphenyl)-N-(1-phenylethyl)-1H-1,2,3-triazole-4-carboxamide
Smiles: Cc1ccc(cc1)n1nnc(c1N)C(=O)NC(c1ccccc1)C

STK618292
Synonyms: 3-(4-chlorophenyl)-4-methyl-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-2-oxo-2H-chromen-7-olate
Smiles: CN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(=O)c(c2C)c1ccc(cc1)Cl

STK618294
Synonyms: 3-[(6-methoxy-1H-indol-3-yl)methyl]-2-(pyridin-3-ylmethyl)-3,4-dihydro-2H-1,2-benzothiazin-4-ol1,1-dioxide
Smiles: COc1ccc2c(c1)[nH]cc2CC1C(O)c2ccccc2S(=O)(=O)N1Cc1cccnc1

STK618295
Synonyms: N-[3-(dimethylamino)propyl]-1-(pyrimidin-2-yl)piperidine-4-carboxamide
Smiles: CN(CCCNC(=O)C1CCN(CC1)c1ncccn1)C

STK618297
Synonyms: 4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-5-imino-1-(6-methylheptan-2-yl)-2,5-dihydro-1H-pyrrol-3-ol
Smiles: CC(CCCC(N1CC(=C(C1=N)c1scc(n1)c1ccc(cc1)Cl)O)C)C

STK618298
Synonyms: N-[2-(morpholin-4-yl)ethyl]-2-[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)oxy]acetamide
Smiles: O=C(COc1ccc2c(c1)c(=O)n1c(n2)CCCCC1)NCCN1CCOCC1

STK618299
Synonyms: 1-(3,4-dimethylphenyl)-2-phenyl-1H-imidazo[4,5-b]quinoxaline
Smiles: Cc1cc(ccc1C)n1c(nc2c1nc1ccccc1n2)c1ccccc1

STK618302
Synonyms: (2S)-N-(2-bromophenyl)-2-(4-oxoquinazolin-3(4H)-yl)propanamide
Smiles: Brc1ccccc1NC(=O)[C@@H](n1cnc2c(c1=O)cccc2)C

STK618303
Synonyms: 5-imino-1-(morpholin-4-yl)-4-(4-phenyl-1,3-thiazol-2-yl)-2,5-dihydro-1H-pyrrol-3-ol
Smiles: OC1=C(c2scc(n2)c2ccccc2)C(=N)N(C1)N1CCOCC1

STK618306
Synonyms: trans-4-({[(4-chlorophenyl)sulfonyl]amino}methyl)-N-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]cyclohexanecarboxamide
Smiles: CCN1CCN(CC1)C(=O)CNC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)Cl

STK618308
Synonyms: 4-{[2-(2-fluorophenyl)ethyl]amino}tetrahydrothiophene-3-ol1,1-dioxide
Smiles: OC1CS(=O)(=O)CC1NCCc1ccccc1F

STK618309
Synonyms: prop-2-en-1-yl2-{(3E)-2-(4-ethoxyphenyl)-3-[hydroxy(4-methoxy-2-methylphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: C=CCOC(=O)c1sc(nc1C)N1C(c2ccc(cc2)OCC)/C(=C(/c2ccc(cc2C)OC)\O)/C(=O)C1=O

STK618310
Synonyms: (4E)-5-(3,4-dimethoxyphenyl)-4-{hydroxy[4-(prop-2-en-1-yloxy)phenyl]methylidene}-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: C=CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)OC)OC)c1noc(c1)C)/O

STK618312
Synonyms: 7-(5-bromopyridin-2-yl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Brc1ccc(nc1)n1c(C)c(c2c1ncn1c2ncn1)C

STK618315
Synonyms: trans-4-({[(4-methylphenyl)sulfonyl]amino}methyl)-N-[(2R)-1-(morpholin-4-yl)-1-oxopropan-2-yl]cyclohexanecarboxamide
Smiles: Cc1ccc(cc1)S(=O)(=O)NC[C@@H]1CC[C@H](CC1)C(=O)N[C@@H](C(=O)N1CCOCC1)C

STK618316
Synonyms: 2-{2-[(2-methoxyphenoxy)methyl]-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl}-N,N-dimethylethanamine
Smiles: COc1ccccc1OCc1nn2c(n1)c1c(nc2)n(c(c1C)C)CCN(C)C

STK618319
Synonyms: 5-ethyl-8-oxo-N-(quinolin-5-yl)-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Smiles: CCn1cc(C(=O)Nc2cccc3c2cccn3)c(=O)c2c1cc1OCOc1c2

STK618320
Synonyms: N-[2-(4-fluorophenyl)ethyl]-2-[(1-oxo-1H-isochromen-3-yl)methyl]benzamide
Smiles: Fc1ccc(cc1)CCNC(=O)c1ccccc1Cc1cc2ccccc2c(=O)o1

STK618322
Synonyms: (4Z)-5-hydroxy-4-{4-[2-(2-phenoxyethoxy)ethoxy]benzylidene}-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: OC1=NN(C(=O)/C/1=C\c1ccc(cc1)OCCOCCOc1ccccc1)c1ccccc1

STK618323
Synonyms: N-cyclohexyl-N-methyl-2-[(2-methyl-4-oxo-3-phenyl-4H-chromen-7-yl)oxy]acetamide
Smiles: O=C(N(C1CCCCC1)C)COc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C

STK618324
Synonyms: 4-(5-{(E)-[1-(4-chlorophenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}furan-2-yl)benzoicacid
Smiles: Clc1ccc(cc1)N1C(=NC(=O)/C(=C\c2ccc(o2)c2ccc(cc2)C(=O)O)/C1=O)S

STK618325
Synonyms: N-{3-(1H-benzimidazol-2-yl)-1-[2-(4-methoxyphenyl)ethyl]-4,5-dimethyl-1H-pyrrol-2-yl}-2-methylpropanamide
Smiles: COc1ccc(cc1)CCn1c(NC(=O)C(C)C)c(c(c1C)C)c1nc2c([nH]1)cccc2

STK618328
Synonyms: N-(3-fluorophenyl)-3-[(4S)-1-(4-methoxybenzyl)-2,5-dioxoimidazolidin-4-yl]propanamide
Smiles: COc1ccc(cc1)CN1C(=O)N[C@H](C1=O)CCC(=O)Nc1cccc(c1)F

STK618330
Synonyms: {2-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethoxy]phenyl}phosphonicacid
Smiles: O=C(Nc1ccc2c(c1)OCO2)COc1ccccc1P(=O)(O)O

STK618331
Synonyms: 3-(2-oxo-2-{4-[2-(pyridin-4-yl)ethyl]piperazin-1-yl}ethyl)quinazolin-4(3H)-one
Smiles: O=C(N1CCN(CC1)CCc1ccncc1)Cn1cnc2c(c1=O)cccc2

STK618333
Synonyms: N-[2-hydroxy-1-(4-methylphenyl)-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl]-2-phenylacetamide
Smiles: O=C(NC1(N=C(N(C1=O)c1ccc(cc1)C)O)C(F)(F)F)Cc1ccccc1

STK618334
Synonyms: 2-methoxy-N-[(6-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(4-methoxyphenyl)acetamide
Smiles: COCC(=O)N(c1ccc(cc1)OC)Cc1cc2cc(OC)ccc2[nH]c1=O

STK618335
Synonyms: 4-methoxy-N'-(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)benzohydrazide
Smiles: COc1ccc(cc1)C(=O)NNc1ncnc2c1cnn2C

STK618337
Synonyms: 2-(3-tert-butyl-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)-N-[4-(2-hydroxyethyl)phenyl]acetamide
Smiles: OCCc1ccc(cc1)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1C(C)(C)C

STK618343
Synonyms: (2E)-2-(1,3-benzoxazol-2-yl)-1-(3-methoxyphenyl)-3-(2-nitrophenyl)prop-2-en-1-one
Smiles: COc1cccc(c1)C(=O)/C(=C/c1ccccc1[N+](=O)[O-])/c1nc2c(o1)cccc2

STK618345
Synonyms: 4-methyl-7-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethoxy)-2H-chromen-2-one
Smiles: O=C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)COc1ccc2c(c1)oc(=O)cc2C

STK618346
Synonyms: 1-(2-chloro-7H-purin-6-yl)-N-[2-(5-fluoro-1H-indol-3-yl)ethyl]piperidine-3-carboxamide
Smiles: O=C(C1CCCN(C1)c1nc(Cl)nc2c1[nH]cn2)NCCc1c[nH]c2c1cc(F)cc2

STK618347
Synonyms: 1H-indol-5-yl[4-(pyridin-2-yl)piperazin-1-yl]methanone
Smiles: O=C(c1ccc2c(c1)cc[nH]2)N1CCN(CC1)c1ccccn1

STK618348
Synonyms: (5E)-3-(3-hydroxyphenyl)-5-[(6-methoxyquinolin-2-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1ccc2c(c1)ccc(n2)/C=C\1/SC(=S)N(C1=O)c1cccc(c1)O

STK618349
Synonyms: 4-(4,4-dimethyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-methylbenzenesulfonamide
Smiles: O=C1N(c2ccc(cc2)S(=O)(=O)N(C2CCS(=O)(=O)C2)C)S(=O)(=O)CC1(C)C

STK618350
Synonyms: N-{(2S)-1-[(4-methoxyphenyl)amino]-1-oxopropan-2-yl}-1-(phenylsulfonyl)piperidine-3-carboxamide
Smiles: COc1ccc(cc1)NC(=O)[C@@H](NC(=O)C1CCCN(C1)S(=O)(=O)c1ccccc1)C

STK618351
Synonyms: 1-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-(2-phenyl-1,3-thiazol-4-yl)ethanone
Smiles: Clc1ccc(cc1)C1(O)CCN(CC1)C(=O)Cc1csc(n1)c1ccccc1

STK618352
Synonyms: (4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(3-methoxyphenyl)methylidene]-5-(3-hydroxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)/C(=C\1/C(c2cccc(c2)O)N(C(=O)C1=O)c1nc2c(s1)cc(cc2C)C)/O

STK618354
Synonyms: (2Z)-2-[(5-bromo-1-benzofuran-2-yl)methylidene]-4-methyl-7-[(2-methylpiperidinium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: Brc1ccc2c(c1)cc(o2)/C=C/1\Oc2c(C1=O)c(C)cc(c2C[NH+]1CCCCC1C)[O-]

STK618355
Synonyms: 4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-5-imino-1-[2-(4-methoxyphenyl)ethyl]-2,5-dihydro-1H-pyrrol-3-ol
Smiles: COc1ccc(cc1)CCN1CC(=C(C1=N)c1scc(n1)c1ccc(c(c1)OC)OC)O

STK618357
Synonyms: N-[3-(acetylamino)phenyl]-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)acetamide
Smiles: O=C(Cn1c(O)nc2c(c1=O)cccc2)Nc1cccc(c1)NC(=O)C

STK618358
Synonyms: 3-[(4S)-1-(1,3-benzodioxol-5-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-(2,2-dimethoxyethyl)propanamide
Smiles: COC(CNC(=O)CC[C@@H]1NC(=O)N(C1=O)Cc1ccc2c(c1)OCO2)OC

STK618359
Synonyms: methyl2-{(3E)-2-(4-ethoxyphenyl)-3-[hydroxy(thiophen-2-yl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2cccs2)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)OC

STK618360
Synonyms: 8-{[(1-benzylpiperidin-4-yl)ammonio]methyl}-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-olate
Smiles: COc1ccc(cc1)c1cc(=O)oc2c1ccc(c2C[NH2+]C1CCN(CC1)Cc1ccccc1)[O-]

STK618361
Synonyms: methyl6-methoxy-3-{[(4-methoxyphenyl)carbonyl]amino}-1H-indole-2-carboxylate
Smiles: COc1ccc(cc1)C(=O)Nc1c([nH]c2c1ccc(c2)OC)C(=O)OC

STK618362
Synonyms: 2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-(4H-1,2,4-triazol-4-yl)acetamide
Smiles: COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)Nn1cnnc1

STK618363
Synonyms: 2-[7-(2-chloro-6-fluorobenzyl)-3,9-dimethyl-6,8-dioxo-6,7,8,9-tetrahydro[1,2,4]triazino[3,4-f]purin-1(4H)-yl]acetamide
Smiles: NC(=O)CN1N=C(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1c(F)cccc1Cl

STK618365
Synonyms: N-[(2S)-1-(cyclopentylamino)-4-(methylsulfanyl)-1-oxobutan-2-yl]-1-[(4-fluorophenyl)sulfonyl]piperidine-4-carboxamide
Smiles: CSCC[C@@H](C(=O)NC1CCCC1)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)F

STK618366
Synonyms: 3-{[4-(1H-benzimidazol-2-yl)piperidin-1-yl]carbonyl}-1-cyclopropyl-6,7-difluoro-8-methoxyquinolin-4(1H)-one
Smiles: COc1c(F)c(F)cc2c1n(cc(c2=O)C(=O)N1CCC(CC1)c1nc2c([nH]1)cccc2)C1CC1

STK618368
Synonyms: 2-{1-[8,9-dimethyl-7-(pyridin-2-ylmethyl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]-2-methylpropyl}-1H-isoindole-1,3(2H)-dione
Smiles: CC(C(N1C(=O)c2c(C1=O)cccc2)c1nn2c(n1)c1c(nc2)n(c(c1C)C)Cc1ccccn1)C

STK618370
Synonyms: 5-(2,5-difluorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccc(c(c1)c1n[nH]c(=S)n1c1ccc2c(c1)OCCO2)F

STK618371
Synonyms: (5Z)-5-[(5-methoxy-1H-indol-3-yl)methylidene]-2-(pyridin-3-ylamino)-1,3-thiazol-4(5H)-one
Smiles: COc1ccc2c(c1)c(c[nH]2)/C=C/1\SC(=NC1=O)Nc1cccnc1

STK618372
Synonyms: N-[2-(furan-2-yl)-2-(pyrrolidin-1-yl)ethyl]furan-2-carboxamide
Smiles: O=C(c1ccco1)NCC(c1ccco1)N1CCCC1

STK618376
Synonyms: 6-ethyl-4-oxo-N-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2,5-oxadiazol-3-yl]-4H-chromene-2-carboxamide
Smiles: CCc1ccc2c(c1)c(=O)cc(o2)C(=O)Nc1nonc1c1ccc2c(c1)CCCC2

STK618378
Synonyms: 1-[N-(phenylcarbonyl)glycyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)piperidine-4-carboxamide
Smiles: O=C(N1CCC(CC1)C(=O)NC1CC(C)(C)NC(C1)(C)C)CNC(=O)c1ccccc1

STK618379
Synonyms: (4-phenylpiperazin-1-yl)[1-(pyrimidin-2-yl)piperidin-4-yl]methanone
Smiles: O=C(N1CCN(CC1)c1ccccc1)C1CCN(CC1)c1ncccn1

STK618387
Synonyms: N-(1,1-dioxido-2,3-dihydrothiophen-3-yl)-3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)propanamide
Smiles: O=C(NC1C=CS(=O)(=O)C1)CCc1c(=O)oc2c(c1C)ccc(c2)O

STK618388
Synonyms: N-[3-methyl-2-(phenylcarbonyl)-1-benzofuran-5-yl]-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Smiles: O=C(Nc1ccc2c(c1)c(C)c(o2)C(=O)c1ccccc1)CCCn1nnc2c(c1=O)cccc2

STK618389
Synonyms: (4E)-5-(4-tert-butylphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(5-methylfuran-2-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CCc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)C(C)(C)C)/C(=C(/c2ccc(o2)C)\O)/C(=O)C1=O

STK618390
Synonyms: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-[(5-nitropyridin-2-yl)amino]propan-1-one
Smiles: COc1ccc(cc1)N1CCN(CC1)C(=O)CCNc1ccc(cn1)[N+](=O)[O-]

STK618392
Synonyms: (4E)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-1-[3-(morpholin-4-yl)propyl]-5-(pyridin-3-yl)pyrrolidine-2,3-dione
Smiles: CC(Oc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)CCCN1CCOCC1)/O)C

STK618396
Synonyms: 3-hydroxy-N-[4-(methylsulfanyl)-1-oxo-1-(phenylamino)butan-2-yl]quinoxaline-1(2H)-carboxamide
Smiles: CSCCC(C(=O)Nc1ccccc1)NC(=O)N1CC(=Nc2c1cccc2)O

STK618397
Synonyms: 3-{(4S)-1-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2,5-dioxoimidazolidin-4-yl}-N-propylpropanamide
Smiles: CCCNC(=O)CC[C@@H]1NC(=O)N(C1=O)CCc1c[nH]c2c1cc(F)cc2

STK618400
Synonyms: 4,4-dimethyl-2-(4-{[4-(pyridin-2-yl)piperazin-1-yl]sulfonyl}phenyl)-1,2-thiazolidin-3-one1,1-dioxide
Smiles: O=C1N(c2ccc(cc2)S(=O)(=O)N2CCN(CC2)c2ccccn2)S(=O)(=O)CC1(C)C

STK618404
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-[3-(1H-imidazol-1-yl)propyl]-5-[4-(propan-2-yl)phenyl]pyrrolidine-2,3-dione
Smiles: O=C1C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C(N1CCCn1cncc1)c1ccc(cc1)C(C)C

STK618405
Synonyms: 2-methyl-4-(4-methyl-1,1-dioxido-3-oxo-1,2-thiazolidin-2-yl)-N-(4-sulfamoylphenyl)benzenesulfonamide
Smiles: O=C1C(C)CS(=O)(=O)N1c1ccc(c(c1)C)S(=O)(=O)Nc1ccc(cc1)S(=O)(=O)N

STK618406
Synonyms: 4-[3-(4-methoxyphenyl)-5-(quinoxalin-6-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: COc1ccc(cc1)C1=NN(C(C1)c1ccc2c(c1)nccn2)C(=O)CCC(=O)O

STK618407
Synonyms: 1-(1,3-benzodioxol-5-ylmethyl)-4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-5-imino-2,5-dihydro-1H-pyrrol-3-ol
Smiles: COc1cc(ccc1OC)c1csc(n1)C1=C(O)CN(C1=N)Cc1ccc2c(c1)OCO2

STK618408
Synonyms: N,1-dicyclopropyl-7-(4-ethylpiperazin-1-yl)-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCN1CCN(CC1)c1cc2c(cc1F)c(=O)c(cn2C1CC1)C(=O)NC1CC1

STK618409
Synonyms: (2Z)-2-(biphenyl-4-ylmethylidene)-7-[(dipropylammonio)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1ccc(cc1)c1ccccc1)/C2=O)CCC

STK618412
Synonyms: 2-(8-cyclohexyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)-N'-[(E)-(3-methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cccc(c1)/C=N/NC(=O)CN1CCn2c3C1CCCc3c1c2ccc(c1)C1CCCCC1