FULL DB

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

STK852455
Synonyms: 2-(5-methyl-1,2-oxazol-3-yl)-1-(3-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1cccc(c1)[N+](=O)[O-])c(=O)c1c(o2)cccc1

STK852456
Synonyms: 2-(3-hydroxy-5-methyl-4H-pyrazol-4-yl)-N'-[(E)-(3-methylthiophen-2-yl)methylidene]acetohydrazide
Smiles: O=C(CC1C(=NN=C1O)C)N/N=C/c1sccc1C

STK852457
Synonyms: 1-(3-chlorophenyl)-7-fluoro-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Clc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK852458
Synonyms: N-[2-(4-chlorophenyl)ethyl]-2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)c(O)cc(c2)C)NCCc1ccc(cc1)Cl

STK852459
Synonyms: 3-[(5Z)-5-(1H-indol-3-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-1-phenylpyrrolidine-2,5-dione
Smiles: S=C1S/C(=C\c2c[nH]c3c2cccc3)/C(=O)N1C1CC(=O)N(C1=O)c1ccccc1

STK852464
Synonyms: 8-(4-ethoxyphenyl)-1,6,7-trimethyl-3-[2-(morpholin-4-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CCOc1ccc(cc1)n1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)CCN1CCOCC1

STK852466
Synonyms: 3-[(2,4-dimethoxyphenyl)amino]-2-benzofuran-1(3H)-one
Smiles: COc1cc(OC)ccc1NC1OC(=O)c2c1cccc2

STK852467
Synonyms: N-[4-(dimethylsulfamoyl)phenyl]pyridine-2-carboxamide
Smiles: O=C(c1ccccn1)Nc1ccc(cc1)S(=O)(=O)N(C)C

STK852469
Synonyms: ethyl4-{[7-(2,6-dichlorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)Cc1nc2c(n1Cc1c(Cl)cccc1Cl)c(=O)n(c(=O)n2C)C

STK852470
Synonyms: 1-[(2,4-dichlorobenzyl)oxy]-1H-benzotriazole
Smiles: Clc1ccc(c(c1)Cl)COn1nnc2c1cccc2

STK852472
Synonyms: 6-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylsulfonyl)-3-methyl-1,3-benzoxazol-2(3H)-one
Smiles: Cn1c(=O)oc2c1ccc(c2)S(=O)(=O)N1CCC2(CC1)OCCO2

STK852474
Synonyms: 4-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-(pyridin-3-ylmethyl)butanamide
Smiles: O=C(NCc1cccnc1)CCCc1onc(n1)c1ccccc1Cl

STK852475
Synonyms: 1-{4-[(1-methyl-5-nitro-1H-benzimidazol-2-yl)methyl]piperazin-1-yl}-2-[5-methyl-2-(propan-2-yl)phenoxy]ethanone
Smiles: Cc1ccc(c(c1)OCC(=O)N1CCN(CC1)Cc1nc2c(n1C)ccc(c2)[N+](=O)[O-])C(C)C

STK852476
Synonyms: N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: O=c1c2cc(n(c2nc2n1cccc2)C)C(=O)Nc1c(=O)n(n(c1C)C)c1ccccc1

STK852477
Synonyms: ethyl2-{[4-(3-methylphenoxy)butanoyl]amino}-5-phenylthiophene-3-carboxylate
Smiles: CCOC(=O)c1cc(sc1NC(=O)CCCOc1cccc(c1)C)c1ccccc1

STK852479
Synonyms: methyl1-[(2-oxo-2H-chromen-3-yl)carbonyl]piperidine-4-carboxylate
Smiles: COC(=O)C1CCN(CC1)C(=O)c1cc2ccccc2oc1=O

STK852481
Synonyms: N-(2-bromophenyl)-4-hydroxy-1-methyl-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: Brc1ccccc1NC(=O)c1c(O)c2ccccc2n(c1=O)C

STK852482
Synonyms: 1-(3-ethoxyphenyl)-7-fluoro-2-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1cccc(c1)C1N(C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK852483
Synonyms: 2-(1H-benzimidazol-2-yl)-5-propyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: CCCc1[nH]n(c(=O)c1)c1nc2c([nH]1)cccc2

STK852485
Synonyms: 1,3-dimethyl-8-(2-methylphenyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: Cc1ccccc1N1CCn2c1nc1c2c(=O)n(c(=O)n1C)C

STK852486
Synonyms: 2-{[4-(diphenylmethyl)piperazin-1-yl]carbonyl}-1-methylpyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-4(1H)-one
Smiles: O=c1c2cc(n(c2nc2n1cccc2)C)C(=O)N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK852487
Synonyms: 1-ethyl-4-[(2-hydroxy-2-phenylethyl)amino]-3-nitroquinolin-2(1H)-one
Smiles: CCn1c2ccccc2c(c(c1=O)[N+](=O)[O-])NCC(c1ccccc1)O

STK852488
Synonyms: 4-[(4-methoxyphenyl)amino]-1-methyl-3-nitroquinolin-2(1H)-one
Smiles: COc1ccc(cc1)Nc1c([N+](=O)[O-])c(=O)n(c2c1cccc2)C

STK852490
Synonyms: 8-(4-chlorophenyl)-1-methyl-3-propyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: CCCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccc(cc1)Cl

STK852495
Synonyms: 4-(4-chlorophenyl)-4,10-dihydro[1,3,5]triazino[1,2-a]benzimidazol-2-amine
Smiles: Clc1ccc(cc1)C1N=C(N)N=c2n1c1ccccc1[nH]2

STK852496
Synonyms: 2-{[(5E)-5-(acetylimino)-4,5-dihydro-1,3,4-thiadiazol-2-yl]sulfanyl}-N-cyclohexylacetamide
Smiles: O=C(NC1CCCCC1)CSc1n[nH]/c(=N\C(=O)C)/s1

STK852499
Synonyms: 7-(4-fluorophenyl)-3-(thiophen-2-yl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Fc1ccc(cc1)n1ncc2c1ncn1c2nnc1c1cccs1

STK852501
Synonyms: 7-fluoro-2-(5-methyl-1,2-oxazol-3-yl)-1-phenyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccccc1)c1noc(c1)C

STK852502
Synonyms: N-(3,4-difluorophenyl)-2-{[4-(4-methylphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)F)F)CSc1nnc(n1c1ccc(cc1)C)c1ccccn1

STK852504
Synonyms: N-(2,5-dimethylphenyl)-6-(4-hydroxy-3-methoxyphenyl)-4-methyl-2-sulfanyl-1,6-dihydropyrimidine-5-carboxamide
Smiles: COc1cc(ccc1O)C1NC(=NC(=C1C(=O)Nc1cc(C)ccc1C)C)S

STK852505
Synonyms: 3-(1H-benzimidazol-2-yl)-1-(4-benzylpiperidin-1-yl)propan-1-one
Smiles: O=C(N1CCC(CC1)Cc1ccccc1)CCc1nc2c([nH]1)cccc2

STK852508
Synonyms: 8-(2-chloro-6-fluorophenyl)-3-(2,4-dimethoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: COc1ccc(c(c1)OC)N1CSC2=C(C#N)C(CC(=O)N2C1)c1c(F)cccc1Cl

STK852510
Synonyms: 8-(4-fluorophenyl)-1-methyl-3-(2-methylpropyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: CC(Cn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccc(cc1)F)C

STK852511
Synonyms: 4-(4-phenoxyphenyl)-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: S=c1[nH]nc(n1c1ccc(cc1)Oc1ccccc1)c1ccncc1

STK852512
Synonyms: 2',3',4',4a'-tetrahydro-1'H,6'H-spiro[indene-2,5'-pyrido[1,2-a]quinoline]-1,3-dione
Smiles: O=C1c2ccccc2C(=O)C21Cc1ccccc1N1C2CCCC1

STK852513
Synonyms: ethyl[(2Z)-2-{[(4-chlorophenyl)carbonyl]imino}-2,3-dihydro-1,3-thiazol-4-yl]acetate
Smiles: CCOC(=O)Cc1cs/c(=N\C(=O)c2ccc(cc2)Cl)/[nH]1

STK852514
Synonyms: 5-tert-butyl-7-(3,5-dimethyl-1H-pyrazol-1-yl)-3-phenylpyrazolo[1,5-a]pyrimidine
Smiles: Cc1nn(c(c1)C)c1cc(nc2n1ncc2c1ccccc1)C(C)(C)C

STK852521
Synonyms: 3-(2-methoxyphenyl)-5-methyl-N-(3-methylbutyl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: COc1ccccc1c1cnn2c1nc(C)cc2NCCC(C)C

STK852522
Synonyms: 3-(3-hydroxypropyl)-8-(3-methoxyphenyl)-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1cccc(c1)OC)C

STK852523
Synonyms: 3-(2-chlorophenyl)-4-oxo-4H-chromen-7-yl4-fluorobenzoate
Smiles: Fc1ccc(cc1)C(=O)Oc1ccc2c(c1)occ(c2=O)c1ccccc1Cl

STK852526
Synonyms: 7-(ethylsulfanyl)-12,12-dimethyl-12,13-dihydro-10H-pyrano[4',3':4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidine
Smiles: CCSc1nnc2n1c1sc3c(c1c1n2ncn1)CC(OC3)(C)C

STK852527
Synonyms: 7-bromo-2-(5-methyl-1,2-oxazol-3-yl)-1-(4-methylphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1ccc(cc1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Br

STK852528
Synonyms: 4-[3-acetyl-2-(4-fluorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]benzenesulfonamide
Smiles: Fc1ccc(cc1)C1N(c2ccc(cc2)S(=O)(=O)N)C(=O)C(=C1C(=O)C)O

STK852529
Synonyms: 3,4,5-triethoxy-N-[(2E)-6-nitro-1,3-benzothiazol-2(3H)-ylidene]benzamide
Smiles: CCOc1cc(cc(c1OCC)OCC)C(=O)/N=c\1/sc2c([nH]1)ccc(c2)[N+](=O)[O-]

STK852531
Synonyms: 2-(4-fluorophenoxy)-N-[4-(4-methoxyphenyl)-1,2,5-oxadiazol-3-yl]propanamide
Smiles: COc1ccc(cc1)c1nonc1NC(=O)C(Oc1ccc(cc1)F)C

STK852532
Synonyms: (2Z)-7-[(dimethylammonio)methyl]-2-[(2E)-3-(2-methoxyphenyl)prop-2-en-1-ylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: COc1ccccc1/C=C/C=C/1\Oc2c(C1=O)ccc(c2C[NH+](C)C)[O-]

STK852534
Synonyms: N-[(2E)-6-(morpholin-4-ylsulfonyl)-1,3-benzothiazol-2(3H)-ylidene]-3-phenylpropanamide
Smiles: O=C(/N=c\1/sc2c([nH]1)ccc(c2)S(=O)(=O)N1CCOCC1)CCc1ccccc1

STK852537
Synonyms: 8-(4-methoxyphenyl)-1-methyl-3-propyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: CCCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccc(cc1)OC

STK852538
Synonyms: (4Z)-6-(1-benzofuran-2-yl)-4-[(2,5-dimethoxyphenyl)imino]-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: COc1ccc(c(c1)/N=c/1\nc(N)nc([nH]1)c1cc2c(o1)cccc2)OC

STK852543
Synonyms: N-[(2Z)-4-(4-bromophenyl)-1,3-thiazol-2(3H)-ylidene]-1-benzofuran-2-carboxamide
Smiles: Brc1ccc(cc1)c1cs/c(=N\C(=O)c2cc3c(o2)cccc3)/[nH]1

STK852544
Synonyms: 5-[(2E)-2-(4-hydroxy-3,5-dimethoxybenzylidene)hydrazinyl]-6-methyl-1,2,4-triazin-3-ol
Smiles: COc1cc(/C=N/Nc2nc(O)nnc2C)cc(c1O)OC

STK852545
Synonyms: N-(6,7-dimethoxy-4-oxo-2-sulfanylquinazolin-3(4H)-yl)thiophene-2-carboxamide
Smiles: COc1cc2c(cc1OC)nc(n(c2=O)NC(=O)c1cccs1)S

STK852546
Synonyms: 1-methyl-8-phenyl-3-(2-phenylethyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: O=c1n(CCc2ccccc2)c(=O)c2c(n1C)nc1n2CCN1c1ccccc1

STK852548
Synonyms: (2Z)-7-{[bis(2-methoxyethyl)ammonio]methyl}-2-(4-chlorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: COCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1ccc(cc1)Cl)/C2=O)CCOC

STK852550
Synonyms: (2Z)-7-[(4-ethylpiperazin-1-ium-1-yl)methyl]-2-(3-methylbenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1cccc(c1)C)/C2=O

STK852551
Synonyms: 8-[2-(3,4-dimethoxyphenyl)ethyl]-1,6,7-trimethyl-3-propyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CCCn1c(=O)n(C)c2c(c1=O)n1c(n2)n(c(c1C)C)CCc1ccc(c(c1)OC)OC

STK852555
Synonyms: 1-oxo-3-phenyl-N-(1,3-thiazol-2-yl)-3,4-dihydro-1H-isochromene-6-carboxamide
Smiles: O=C(c1ccc2c(c1)CC(OC2=O)c1ccccc1)Nc1nccs1

STK852556
Synonyms: 1,3-dimethyl-8-(morpholin-4-ylmethyl)-7-(2-oxo-2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=C(c1ccccc1)Cn1c(CN2CCOCC2)nc2c1c(=O)n(C)c(=O)n2C

STK852557
Synonyms: (2E)-2-cyano-3-(5-phenylfuran-2-yl)-N-(quinolin-5-yl)prop-2-enamide
Smiles: N#C/C(=C\c1ccc(o1)c1ccccc1)/C(=O)Nc1cccc2c1cccn2

STK852558
Synonyms: 8-[benzyl(methyl)amino]-7-{2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]ethyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cc(C)nc(n1)SCCn1c(nc2c1c(=O)n(C)c(=O)n2C)N(Cc1ccccc1)C

STK852559
Synonyms: 4,7,7-trimethyl-3-oxo-N-[4-(trifluoromethoxy)phenyl]-2-oxabicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)O1)C)Nc1ccc(cc1)OC(F)(F)F

STK852560
Synonyms: N-[(2Z)-1,3-benzothiazol-2(3H)-ylidene]-4-(4-chlorophenoxy)butanamide
Smiles: Clc1ccc(cc1)OCCCC(=O)/N=c/1\sc2c([nH]1)cccc2

STK852561
Synonyms: N-[(2Z)-5-methyl-4-(4-methylphenyl)-1,3-thiazol-2(3H)-ylidene]-4-(4-methylphenoxy)butanamide
Smiles: Cc1ccc(cc1)OCCCC(=O)/N=c/1\sc(c([nH]1)c1ccc(cc1)C)C

STK852562
Synonyms: ethyl[2-({(E)-[2-(3,4-dimethylphenyl)-1,3-dioxo-2,3-dihydroisoquinolin-4(1H)-ylidene]methyl}amino)-1,3-thiazol-4-yl]acetate
Smiles: CCOC(=O)Cc1csc(n1)N/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccc(c(c1)C)C

STK852565
Synonyms: 3-(but-3-en-2-yl)-1-methyl-8-(4-phenoxyphenyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: C=CC(n1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccc(cc1)Oc1ccccc1)C

STK852566
Synonyms: 9-(4-ethylphenyl)-1-methyl-3-(prop-2-en-1-yl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: C=CCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccc(cc1)CC

STK852568
Synonyms: (2Z)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/c1cc(Br)c(c(c1)OC)O)/c1scc(n1)c1ccc(cc1)Cl

STK852569
Synonyms: methyl4-[7-methyl-2-(5-methyl-1,2-oxazol-3-yl)-3,9-dioxo-1,2,3,9-tetrahydrochromeno[2,3-c]pyrrol-1-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C

STK852571
Synonyms: 3-(3-hydroxypropyl)-8-(2-methoxyphenyl)-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1ccccc1OC)C

STK852572
Synonyms: 2-methoxy-N-[(2Z)-6-methyl-1,3-benzothiazol-2(3H)-ylidene]-4-(methylsulfanyl)benzamide
Smiles: COc1cc(SC)ccc1C(=O)/N=c/1\sc2c([nH]1)ccc(c2)C

STK852574
Synonyms: 3-(3,4-dimethoxyphenyl)-2,5-dimethyl-7-(2-methyl-1H-imidazol-1-yl)pyrazolo[1,5-a]pyrimidine
Smiles: COc1cc(ccc1OC)c1c(C)nn2c1nc(C)cc2n1ccnc1C

STK852575
Synonyms: 2-methoxy-N-({1-[2-(4-methylphenoxy)ethyl]-1H-benzimidazol-2-yl}methyl)aniline
Smiles: COc1ccccc1NCc1nc2c(n1CCOc1ccc(cc1)C)cccc2

STK852576
Synonyms: 3-(4-bromophenyl)-8-(2,5-dimethoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1cc(OC)ccc1OC)c1ccc(cc1)Br

STK852577
Synonyms: N-[(2Z)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methylpropanamide
Smiles: O=C(C(C)C)/N=C/1\SC2C(N1c1ccc3c(c1)OCCO3)CS(=O)(=O)C2

STK852583
Synonyms: N-(3-bromophenyl)-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Smiles: O=C(Nc1cccc(c1)Br)CCCn1nnc2c(c1=O)cccc2

STK852584
Synonyms: 2-{[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl}-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc2CCN(Cc2cc1OC)S(=O)(=O)c1ccc(c(c1)C(F)(F)F)Cl

STK852585
Synonyms: ethyl4-{[7-(3,4-dichlorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)Cc1nc2c(n1Cc1ccc(c(c1)Cl)Cl)c(=O)n(c(=O)n2C)C

STK852586
Synonyms: (5Z)-3-benzyl-5-{[5-(3-fluorophenyl)furan-2-yl]methylidene}-2-hydroxy-3,5-dihydro-4H-imidazol-4-one
Smiles: Fc1cccc(c1)c1ccc(o1)/C=C/1\N=C(N(C1=O)Cc1ccccc1)O

STK852588
Synonyms: 1-(3-methoxypropyl)-9-methyl-N-(2-methylcyclohexyl)-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)NC1CCCCC1C

STK852592
Synonyms: N-[2-hydroxy-1-(4-methylphenyl)-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl]pyridine-3-carboxamide
Smiles: Cc1ccc(cc1)N1C(=NC(C1=O)(NC(=O)c1cccnc1)C(F)(F)F)O

STK852593
Synonyms: 1,7-dimethyl-8-(4-methylphenyl)-3-(2-methylprop-2-en-1-yl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(=C)Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1ccc(cc1)C)C

STK852594
Synonyms: methyl4-[7-fluoro-2-(5-methyl-1,2-oxazol-3-yl)-3,9-dioxo-1,2,3,9-tetrahydrochromeno[2,3-c]pyrrol-1-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK852595
Synonyms: 3-(3-chlorophenyl)-8-(3-ethoxy-4-hydroxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: CCOc1cc(ccc1O)C1CC(=O)N2C(=C1C#N)SCN(C2)c1cccc(c1)Cl

STK852597
Synonyms: 8-(2-chlorophenyl)-1,7-dimethyl-3-(2-methylprop-2-en-1-yl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(=C)Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1ccccc1Cl)C

STK852598
Synonyms: 2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-4H-1,3-benzoxazin-4-one
Smiles: COc1cc(cc(c1OC)OC)C1NC(=O)c2c(O1)cccc2

STK852599
Synonyms: 2-[3-methyl-4-(propan-2-yl)phenoxy]-N-[4-(piperidin-1-yl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)N1CCCCC1)COc1ccc(c(c1)C)C(C)C

STK852602
Synonyms: 3-benzyl-8-(2-methoxyphenyl)-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1ccccc1n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1

STK852603
Synonyms: 4-(4-methylphenoxy)-N-[4-(piperidin-1-yl)phenyl]butanamide
Smiles: O=C(Nc1ccc(cc1)N1CCCCC1)CCCOc1ccc(cc1)C

STK852604
Synonyms: 3,4-dimethoxy-N-(2-methoxyethyl)-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COCCN(C(=O)c1ccc(c(c1)OC)OC)Cc1cc2cc(C)ccc2[nH]c1=O

STK852606
Synonyms: N-(2,6-dimethylphenyl)-2-{[4-(4-methoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cccc2C)nnc1c1cccc(c1)C

STK852607
Synonyms: 9-(4-fluorophenyl)-1-methyl-3-(2-methylbenzyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Fc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1C

STK852608
Synonyms: 9-cyclohexyl-1,7-dimethyl-3-(3-oxobutan-2-yl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CC1CN(C2CCCCC2)c2n(C1)c1c(n2)n(C)c(=O)n(c1=O)C(C(=O)C)C

STK852610
Synonyms: 3-benzyl-9-(4-fluorophenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Fc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1

STK852611
Synonyms: 3-[4-(trifluoromethoxy)phenyl]tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-imine5,5-dioxide
Smiles: FC(Oc1ccc(cc1)N1C(=N)SC2C1CS(=O)(=O)C2)(F)F

STK852612
Synonyms: N-(3-chloro-4-methoxyphenyl)-2-{[5-(phenoxymethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2)Cl)OC)nnc1COc1ccccc1

STK852613
Synonyms: (4E)-5-(4-chlorophenyl)-1-hexyl-4-[hydroxy(4-methylphenyl)methylidene]pyrrolidine-2,3-dione
Smiles: CCCCCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/O)/C1c1ccc(cc1)Cl

STK852615
Synonyms: 3-ethoxy-N-(4-phenyl-1,2,5-oxadiazol-3-yl)benzamide
Smiles: CCOc1cccc(c1)C(=O)Nc1nonc1c1ccccc1

STK852616
Synonyms: (5E)-5-[4-(dimethylamino)benzylidene]-2,6-dihydroxypyrimidin-4(5H)-one
Smiles: OC1=NC(=O)/C(=C/c2ccc(cc2)N(C)C)/C(=N1)O

STK852618
Synonyms: N-[(2Z)-5-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylpropanamide
Smiles: Brc1ccc(cc1)C(=O)CSc1n[nH]/c(=N/C(=O)CCc2ccccc2)/s1

STK852621
Synonyms: 4,7,7-trimethyl-3-oxo-N-[4-(trifluoromethoxy)phenyl]bicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1)C)Nc1ccc(cc1)OC(F)(F)F

STK852627
Synonyms: 4-methyl-N-[(2E)-6-(methylsulfonyl)-1,3-benzothiazol-2(3H)-ylidene]-3-nitrobenzamide
Smiles: O=C(c1ccc(c(c1)[N+](=O)[O-])C)/N=c\1/sc2c([nH]1)ccc(c2)S(=O)(=O)C

STK852630
Synonyms: (6Z)-5-imino-6-[(4-oxo-4H-chromen-3-yl)methylidene]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: O=C1N=c2scnn2C(=N)/C/1=C/c1coc2c(c1=O)cccc2

STK852632
Synonyms: 3-(4-fluorobenzyl)-9-(2-methoxyphenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COc1ccccc1N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1)F

STK852633
Synonyms: 8,8-dimethyl-3-(3-phenylpropyl)-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-4(3H)-one
Smiles: O=c1n(CCCc2ccccc2)cnc2c1oc1c2cc2c(n1)CC(OC2)(C)C

STK852634
Synonyms: N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)hydrazinecarbothioamide
Smiles: NNC(=S)Nc1c(C)n(n(c1=O)c1ccccc1)C

STK852636
Synonyms: 7-chloro-2-(pyridin-2-yl)-1-(pyridin-4-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Clc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccncc1)c1ccccn1

STK852640
Synonyms: 4-chloro-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(pyridin-3-ylmethyl)benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)N(Cc1cc2ccc(cc2[nH]c1=O)C)Cc1cccnc1

STK852641
Synonyms: 3-(4-methoxyphenyl)-2-{[1-(morpholin-4-yl)-1-oxopropan-2-yl]sulfanyl}quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)n1c(SC(C(=O)N2CCOCC2)C)nc2c(c1=O)cccc2

STK852645
Synonyms: N-(4-fluorophenyl)-6-(4-hydroxyphenyl)-4-methyl-2-sulfanyl-1,6-dihydropyrimidine-5-carboxamide
Smiles: SC1=NC(=C(C(N1)c1ccc(cc1)O)C(=O)Nc1ccc(cc1)F)C

STK852646
Synonyms: 8-(3-methoxyphenyl)-1,7-dimethyl-3-(2-methylpropyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1cccc(c1)n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CC(C)C

STK852647
Synonyms: (4E)-5-(2-fluorophenyl)-4-[hydroxy(4-nitrophenyl)methylidene]-1-(4-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)[N+](=O)[O-])/O)/C1c1ccccc1F

STK852649
Synonyms: (2Z)-7-[(4-ethylpiperazin-1-ium-1-yl)methyl]-2-(2-methylbenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1ccccc1C)/C2=O

STK852650
Synonyms: 2-[(4-chlorobenzyl)sulfanyl]-6-hydroxy-4-(2-methoxyphenyl)-4,5-dihydropyridine-3-carbonitrile
Smiles: N#CC1=C(SCc2ccc(cc2)Cl)N=C(CC1c1ccccc1OC)O

STK852652
Synonyms: 2-[(5E)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(2-hydroxyethyl)acetamide
Smiles: OCCNC(=O)CN1C(=O)S/C(=C/c2ccccc2)/C1=O

STK852653
Synonyms: 9-(3-chloro-2-methylphenyl)-3-(2-methoxyethyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COCCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1cccc(c1C)Cl

STK852656
Synonyms: ethyl4-(3,4-dimethoxyphenyl)-2-methyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c1ccccc1[nH]2

STK852657
Synonyms: 1-(3-fluorophenyl)-6,7-dimethyl-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1onc(c1)N1C(c2cccc(c2)F)c2c(C1=O)oc1c(c2=O)cc(c(c1)C)C

STK852658
Synonyms: ethyl{[7,7-dimethyl-2-(4-methylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc(nc2c1COC(C2)(C)C)c1ccc(cc1)C

STK852660
Synonyms: (2E,5Z)-3-(4-hydroxyphenyl)-5-(4-methoxybenzylidene)-2-[(2E)-(4-methoxybenzylidene)hydrazinylidene]-1,3-thiazolidin-4-one
Smiles: COc1ccc(cc1)/C=N/N=C\1/S/C(=C\c2ccc(cc2)OC)/C(=O)N1c1ccc(cc1)O

STK852661
Synonyms: 8-(4-ethylphenyl)-1,6,7-trimethyl-3-[2-(morpholin-4-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CCc1ccc(cc1)n1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)CCN1CCOCC1

STK852664
Synonyms: 7-fluoro-2-(6-methylpyridin-2-yl)-1-(pyridin-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1cccnc1)c1cccc(n1)C

STK852665
Synonyms: 2-{[(2Z)-2-(furan-2-ylmethylidene)-7-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetamide
Smiles: NC(=O)COc1ccc2c(c1C)O/C(=C\c1ccco1)/C2=O

STK852666
Synonyms: 7-bromo-2-(furan-2-ylmethyl)-1-(pyridin-4-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Brc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccncc1)Cc1ccco1

STK852672
Synonyms: 8-(3-methoxypropyl)-1,7-dimethyl-3-(2-methylprop-2-en-1-yl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COCCCn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CC(=C)C

STK852674
Synonyms: 1'-benzyl-2'-hydroxy-3-methyl-8-nitro-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidine]-4',6'(1'H)-dione
Smiles: CC1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)N=C(N(C1=O)Cc1ccccc1)O

STK852675
Synonyms: 3-(3-chlorobenzyl)-9-(2,4-dimethoxyphenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COc1cc(OC)ccc1N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1cccc(c1)Cl

STK852677
Synonyms: 1-methyl-1H-imidazo[1,2-a]benzimidazol-2(3H)-one
Smiles: O=C1Cn2c(N1C)nc1c2cccc1

STK852683
Synonyms: 1-benzyl-N-(2-hydroxyethyl)-9-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: OCCNC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1C

STK852686
Synonyms: (2E)-N-[(2Z)-6-(methylsulfonyl)-1,3-benzothiazol-2(3H)-ylidene]-3-phenylprop-2-enamide
Smiles: O=C(/N=c/1\sc2c([nH]1)ccc(c2)S(=O)(=O)C)/C=C/c1ccccc1

STK852690
Synonyms: 2,4-dichlorophenyl4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylate
Smiles: Clc1ccc(c(c1)Cl)OC(=O)C12CCC(C2(C)C)(C(=O)O1)C

STK852692
Synonyms: 4-oxo-1-phenyl-N-[(2Z)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]-1,4-dihydropyridazine-3-carboxamide
Smiles: CC(c1n[nH]/c(=N/C(=O)c2nn(ccc2=O)c2ccccc2)/s1)C

STK852695
Synonyms: methyl1-{[1-(3-methoxypropyl)-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-2-yl]carbonyl}piperidine-4-carboxylate
Smiles: COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)N1CCC(CC1)C(=O)OC

STK852696
Synonyms: (4E)-1-(4-fluorophenyl)-4-[hydroxy(phenyl)methylidene]-5-(4-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1ccc(cc1)F

STK852697
Synonyms: 3-(3-oxo-3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propyl)quinazolin-4(3H)-one
Smiles: O=C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)CCn1cnc2c(c1=O)cccc2

STK852698
Synonyms: 3-(2,3-dihydro-1,4-benzodioxin-2-yl)-N-ethylpropanamide
Smiles: CCNC(=O)CCC1COc2c(O1)cccc2

STK852707
Synonyms: 2,8,10-trimethyl-4-(piperidin-1-yl)pyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidine
Smiles: Cc1cc(N2CCCCC2)n2c(n1)c1c(C)cc(nc1n2)C

STK852708
Synonyms: 7-(3,5-dimethyl-1H-pyrazol-1-yl)-5-methyl-3-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine
Smiles: Cc1ccc(cc1)c1cnn2c1nc(C)cc2n1nc(cc1C)C

STK852709
Synonyms: 4-{3-[(1-oxophthalazin-2(1H)-yl)methyl]-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl}benzenesulfonamide
Smiles: S=c1[nH]nc(n1c1ccc(cc1)S(=O)(=O)N)Cn1ncc2c(c1=O)cccc2

STK852710
Synonyms: N-(3,4-difluorophenyl)-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Smiles: O=C(Nc1ccc(c(c1)F)F)CCCn1nnc2c(c1=O)cccc2

STK852711
Synonyms: (2E)-N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-3-(4-ethoxyphenyl)prop-2-enamide
Smiles: CCOc1ccc(cc1)/C=C/C(=O)/N=c\1/sc2c([nH]1)cccc2

STK852713
Synonyms: 4,7,7-trimethyl-3-oxo-N'-phenyl-2-oxabicyclo[2.2.1]heptane-1-carbohydrazide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)O1)C)NNc1ccccc1

STK852715
Synonyms: 3-(4-chlorophenyl)-4-(3,4,5-trimethoxyphenyl)-2,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: COc1cc(cc(c1OC)OC)C1CC(=O)Nc2c1c([nH]n2)c1ccc(cc1)Cl

STK852716
Synonyms: 8-(4-methoxyphenyl)-1-methyl-3-(prop-2-en-1-yl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: C=CCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccc(cc1)OC

STK852717
Synonyms: 2-(5-chloro-6-methyl-1-benzofuran-3-yl)-N-cyclohexylacetamide
Smiles: O=C(Cc1coc2c1cc(Cl)c(c2)C)NC1CCCCC1

STK852718
Synonyms: N-butyl-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-4-amine
Smiles: CCCCNc1ncnc2c1oc1c2cc2c(n1)CC(OC2)(C)C

STK852720
Synonyms: 6-benzyl-2-(4-chlorophenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: Clc1ccc(cc1)c1nn2c(n1)nc(c(c2O)Cc1ccccc1)C

STK852721
Synonyms: 3,4,5-triethoxy-N-[(2E)-6-methoxy-1,3-benzothiazol-2(3H)-ylidene]benzamide
Smiles: CCOc1cc(cc(c1OCC)OCC)C(=O)/N=c\1/sc2c([nH]1)ccc(c2)OC

STK852724
Synonyms: (2E)-N-[(2Z)-5-[(2-oxo-2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylprop-2-enamide
Smiles: O=C(/N=c\1/[nH]nc(s1)SCC(=O)c1ccccc1)/C=C/c1ccccc1

STK852726
Synonyms: 2-{[4-(2-chlorophenyl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}phthalazin-1(2H)-one
Smiles: S=c1[nH]nc(n1c1ccccc1Cl)Cn1ncc2c(c1=O)cccc2

STK852728
Synonyms: 6-hydroxy-4-(2-methylphenyl)-2-(methylsulfanyl)-4,5-dihydropyridine-3-carbonitrile
Smiles: N#CC1=C(SC)N=C(CC1c1ccccc1C)O

STK852730
Synonyms: 8-(2,3-dimethoxyphenyl)-3-(furan-2-ylmethyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1cccc(c1OC)OC)Cc1ccco1

STK852733
Synonyms: (4E)-5-(2-chlorophenyl)-4-[hydroxy(4-methylphenyl)methylidene]-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Smiles: COCCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/O)/C1c1ccccc1Cl

STK852736
Synonyms: 4-(2,3-dimethoxyphenyl)-1-(4-methylphenyl)-4,7-dihydrofuro[3,4-b]pyridine-2,5(1H,3H)-dione
Smiles: COc1cccc(c1OC)C1CC(=O)N(C2=C1C(=O)OC2)c1ccc(cc1)C

STK852740
Synonyms: 8-(3-chlorophenyl)-1,6,7-trimethyl-3-(2-methylprop-2-en-1-yl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(=C)Cn1c(=O)n(C)c2c(c1=O)n1c(n2)n(c(c1C)C)c1cccc(c1)Cl

STK852741
Synonyms: N-[2-(4-chlorophenyl)ethyl]-2-(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamide
Smiles: COc1c(OC)ccc2c1oc(=O)c(c2C)CC(=O)NCCc1ccc(cc1)Cl

STK852743
Synonyms: (2Z)-7-[(4-methylpiperazin-1-ium-1-yl)methyl]-3-oxo-2-(pyridin-4-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: CN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1ccncc1)/C2=O

STK852745
Synonyms: (2Z)-7-{[bis(2-methoxyethyl)ammonio]methyl}-2-(2,6-dichlorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: COCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1c(Cl)cccc1Cl)/C2=O)CCOC

STK852747
Synonyms: N-(4-fluorophenyl)-6-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)hexanamide
Smiles: O=C(Nc1ccc(cc1)F)CCCCCn1nnc2c(c1=O)cccc2

STK852748
Synonyms: methyl3-[8-(4-chlorophenyl)-1,7-dimethyl-2,4-dioxo-1,2,4,8-tetrahydro-3H-imidazo[2,1-f]purin-3-yl]propanoate
Smiles: COC(=O)CCn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1ccc(cc1)Cl)C

STK852749
Synonyms: 4-[3-(3-bromo-5-ethoxy-4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanamide
Smiles: CCOc1cc(cc(c1OC)Br)c1noc(n1)CCCC(=O)N

STK852751
Synonyms: 2-methyl-N-[1-methyl-4-oxo-3-(pyridin-2-yl)-1,4-dihydroquinolin-2-yl]benzamide
Smiles: Cc1ccccc1C(=O)Nc1c(c2ccccn2)c(=O)c2c(n1C)cccc2

STK852754
Synonyms: 8-(4-fluorophenyl)-1,3,7-trimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Fc1ccc(cc1)n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)C

STK852757
Synonyms: N-(2-chlorobenzyl)-2,4-dihydroxy-5,6,7,8-tetrahydroquinoline-3-carboxamide
Smiles: O=C(c1c(O)nc2c(c1O)CCCC2)NCc1ccccc1Cl

STK852758
Synonyms: N-(4-fluorophenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1nn2c(n1)nc(cc2C)C

STK852761
Synonyms: 2-(6-bromo-2-methoxynaphthalen-1-yl)-N-(5-nitro-1,3-thiazol-2-yl)acetamide
Smiles: COc1ccc2c(c1CC(=O)Nc1ncc(s1)[N+](=O)[O-])ccc(c2)Br

STK852762
Synonyms: (6E)-6-{[5-(3-chlorophenyl)furan-2-yl]methylidene}-7-imino-2-methyl-6,7-dihydro-5H-[1,2]oxazolo[2,3-a]pyrimidin-5-one
Smiles: Clc1cccc(c1)c1ccc(o1)/C=C\1/C(=O)N=c2n(C1=N)oc(c2)C

STK852764
Synonyms: 5-acetyl-2-amino-4-[4-(propan-2-yl)phenyl]-4,5-dihydropyrano[3,2-b]indole-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1)C(C)C)n(C(=O)C)c1c2cccc1

STK852769
Synonyms: 5-(2-chlorophenyl)-4-{[(E)-(2,4-dimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(OC)ccc1/C=N/n1c(=S)[nH]nc1c1ccccc1Cl

STK852770
Synonyms: N-(3-methoxyphenyl)-3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide
Smiles: COc1cccc(c1)NC(=O)CCn1nnc2c(c1=O)cccc2

STK852772
Synonyms: 3,4,5-triethoxy-N-[(2Z)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: CCOc1cc(cc(c1OCC)OCC)C(=O)/N=c\1/[nH]nc(s1)C(C)C

STK852773
Synonyms: 3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[4-(trifluoromethyl)phenyl]propanamide
Smiles: O=C(Nc1ccc(cc1)C(F)(F)F)CCn1nnc2c(c1=O)cccc2

STK852774
Synonyms: 9-(3-chlorophenyl)-3-ethyl-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1cccc(c1)Cl

STK852775
Synonyms: 3-benzyl-8-(4-fluorophenyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: Fc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1

STK852776
Synonyms: N-(4-chlorophenyl)-2-(4-oxo-7,8,9,10-tetrahydropyrimido[4',5':4,5]furo[2,3-b]quinolin-3(4H)-yl)acetamide
Smiles: Clc1ccc(cc1)NC(=O)Cn1cnc2c(c1=O)oc1c2cc2c(n1)CCCC2

STK852781
Synonyms: N-(1H-indazol-6-yl)-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc2c(c1)[nH]nc2)CSc1nnc(n1c1ccccc1)c1nccnc1

STK852784
Synonyms: (4E)-4-[hydroxy(phenyl)methylidene]-1-(3-methylphenyl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: Cc1cccc(c1)N1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1cccc(c1)[N+](=O)[O-]

STK852785
Synonyms: N-[(2E)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-ylidene]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Smiles: Clc1ccc(cc1)c1cs/c(=N/C(=O)c2ccc3c(c2)OCCO3)/[nH]1

STK852786
Synonyms: (4E)-1-benzyl-5-(2-fluorophenyl)-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1ccccc1F)Cc1ccccc1)/c1ccccc1

STK852787
Synonyms: 1-(4-chlorophenyl)-4-(2,3-dimethoxyphenyl)-4,7-dihydrofuro[3,4-b]pyridine-2,5(1H,3H)-dione
Smiles: COc1cccc(c1OC)C1CC(=O)N(C2=C1C(=O)OC2)c1ccc(cc1)Cl

STK852788
Synonyms: (6E)-7-imino-2-methyl-6-[4-(methylsulfanyl)benzylidene]-6,7-dihydro-5H-[1,2]oxazolo[2,3-a]pyrimidin-5-one
Smiles: CSc1ccc(cc1)/C=C\1/C(=O)N=c2n(C1=N)oc(c2)C

STK852789
Synonyms: (3Z)-5-bromo-3-[(2E)-4-oxo-3-(prop-2-en-1-yl)-2-(1,3-thiazol-2-ylimino)-1,3-thiazolidin-5-ylidene]-1,3-dihydro-2H-indol-2-one
Smiles: C=CCN1/C(=N\c2nccs2)/S/C(=C/2\C(=O)Nc3c2cc(Br)cc3)/C1=O

STK852790
Synonyms: (2Z)-2-(3-chlorobenzylidene)-3-oxo-7-(pyrrolidinium-1-ylmethyl)-2,3-dihydro-1-benzofuran-6-olate
Smiles: Clc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCCC1)[O-]

STK852791
Synonyms: 3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-[(E)-2-(2-methyl-1H-indol-3-yl)ethenyl]quinazolin-4(3H)-one
Smiles: Cc1[nH]c2c(c1/C=C/c1nc3ccccc3c(=O)n1c1c(C)n(n(c1=O)c1ccccc1)C)cccc2

STK852792
Synonyms: (2Z)-2-(2-chloro-6-fluorobenzylidene)-7-[(4-ethylpiperazin-1-ium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1c(F)cccc1Cl)/C2=O

STK852793
Synonyms: N-[1-ethyl-3-(4-methoxyphenyl)-4-oxo-1,4-dihydroquinolin-2-yl]furan-2-carboxamide
Smiles: COc1ccc(cc1)c1c(NC(=O)c2ccco2)n(CC)c2c(c1=O)cccc2

STK852794
Synonyms: 7-(2,6-dichlorobenzyl)-1,3-dimethyl-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1cccc(c1Cn1c(CN2CCOCC2)nc2c1c(=O)n(c(=O)n2C)C)Cl

STK852795
Synonyms: (4Z)-4-[(2-methoxy-5-methylphenyl)imino]-6-(3-methyl-1-benzofuran-2-yl)-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: COc1ccc(cc1/N=c/1\nc(N)nc([nH]1)c1oc2c(c1C)cccc2)C

STK852798
Synonyms: 3-benzyl-9-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COc1cc(CCN2CCCn3c2nc2c3c(=O)n(c(=O)n2C)Cc2ccccc2)ccc1OC

STK852800
Synonyms: 8,8-dimethyl-3-(prop-2-en-1-yl)-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-4(3H)-one
Smiles: C=CCn1cnc2c(c1=O)oc1c2cc2c(n1)CC(OC2)(C)C

STK852801
Synonyms: 4-(4-methoxyphenyl)-6-methyl-4,6-dihydro-2H-pyrano[3,2-c]quinoline-2,5(3H)-dione
Smiles: COc1ccc(cc1)C1CC(=O)Oc2c1c(=O)n(c1c2cccc1)C

STK852804
Synonyms: (5Z)-5-(4-methoxybenzylidene)-2-(pyridin-4-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Smiles: COc1ccc(cc1)/C=c/1\sc2n(c1=O)nc(n2)c1ccncc1

STK852805
Synonyms: 1-methyl-8-(3-methylphenyl)-3-(2-methylpropyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: CC(Cn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1cccc(c1)C)C

STK852809
Synonyms: ethyl[10-(4-ethoxyphenyl)-1-methyl-2,4-dioxo-1,2,4,6,7,8,9,10-octahydro-3H-[1,3]diazepino[2,1-f]purin-3-yl]acetate
Smiles: CCOC(=O)Cn1c(=O)n(C)c2c(c1=O)n1CCCCN(c1n2)c1ccc(cc1)OCC

STK852811
Synonyms: 8-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-1,3-dimethyl-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)n(C)c(=O)c2c1nc(n2CCc1ccccc1)CN1CCc2c(C1)cccc2

STK852812
Synonyms: 2-(furan-2-yl)-10-methyl-3-(2-phenylethyl)pyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: O=c1n(CCc2ccccc2)c(nc2c1c(=O)c1ccccc1n2C)c1ccco1

STK852813
Synonyms: (2Z)-3-oxo-7-(piperidinium-1-ylmethyl)-2-(thiophen-2-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: [O-]c1ccc2c(c1C[NH+]1CCCCC1)O/C(=C\c1cccs1)/C2=O

STK852816
Synonyms: 3-(3-hydroxypropyl)-1,6,7-trimethyl-8-(3-methylphenyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1c(n2)n(c(c1C)C)c1cccc(c1)C

STK852823
Synonyms: 4-methyl-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(pyridin-3-ylmethyl)benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N(Cc1cc2cccc(c2[nH]c1=O)C)Cc1cccnc1

STK852824
Synonyms: 5-(4-methoxyphenyl)-4-{[(1E,2E)-2-methyl-3-phenylprop-2-en-1-ylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1)c1n[nH]c(=S)n1/N=C/C(=C/c1ccccc1)/C

STK852825
Synonyms: 3-(3-hydroxypropyl)-1,7,8-trimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)C)C

STK852827
Synonyms: methyl[8-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]acetate
Smiles: COC(=O)Cn1c(CN2CCc3c(C2)cccc3)nc2c1c(=O)n(c(=O)n2C)C

STK852831
Synonyms: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(ccc1Cl)C(F)(F)F)CSc1nnc(n1c1ccccc1)c1cnccn1

STK852832
Synonyms: 2-chloro-N-[(2Z)-5-[(2-oxo-2-{[3-(trifluoromethyl)phenyl]amino}ethyl)sulfanyl]-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CSc1n[nH]/c(=N/C(=O)c2ccccc2Cl)/s1

STK852833
Synonyms: N'-[(1E)-1-(4-hydroxy-3-methoxyphenyl)ethylidene]-5-methyl-1H-pyrazole-3-carbohydrazide
Smiles: COc1cc(ccc1O)/C(=N/NC(=O)c1n[nH]c(c1)C)/C

STK852834
Synonyms: 3-(3-hydroxypropyl)-1,7-dimethyl-8-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1ccccc1)C

STK852836
Synonyms: 9-(2,4-dimethoxyphenyl)-4-methyl-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: COc1cc(OC)ccc1N1COc2c(C1)c1oc(=O)cc(c1cc2)C

STK852838
Synonyms: 2-(2-bromophenyl)-5,6,7,8-tetrahydro-4H-[1]benzothieno[2,3-d][1,3]oxazin-4-one
Smiles: Brc1ccccc1c1oc(=O)c2c(n1)sc1c2CCCC1

STK852839
Synonyms: 4-fluoro-N-[(2Z)-6-(methylsulfonyl)-1,3-benzothiazol-2(3H)-ylidene]benzamide
Smiles: Fc1ccc(cc1)C(=O)/N=c/1\sc2c([nH]1)ccc(c2)S(=O)(=O)C

STK852843
Synonyms: 2-{[4-(3-bromophenyl)-3-cyano-6-hydroxy-4,5-dihydropyridin-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)F)N=C(CC1c1cccc(c1)Br)O

STK852844
Synonyms: 2-[(8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-4-yl)amino]butan-1-ol
Smiles: CCC(Nc1ncnc2c1oc1c2cc2c(n1)CC(OC2)(C)C)CO

STK852846
Synonyms: N-[4-(4-chlorophenyl)-6-methyl-5-oxo-2-phenyl-2,5-dihydropyridazin-3-yl]thiophene-2-carboxamide
Smiles: Clc1ccc(cc1)c1c(NC(=O)c2cccs2)n(nc(c1=O)C)c1ccccc1

STK852847
Synonyms: 1-[4-(3-imino-2',3',5',6'-tetrahydro-1H-spiro[isoquinoline-4,4'-pyran]-2(3H)-yl)phenyl]ethanone
Smiles: N=C1N(Cc2c(C31CCOCC3)cccc2)c1ccc(cc1)C(=O)C

STK852850
Synonyms: 6-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-(pyridin-3-yl)hexanamide
Smiles: O=C(Nc1cccnc1)CCCCCn1nnc2c(c1=O)cccc2

STK852851
Synonyms: 1,7-dimethyl-3-(2-methylprop-2-en-1-yl)-8-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(=C)Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1ccccc1)C

STK852856
Synonyms: N'-[(1E)-1-(2,6-dihydroxy-4-oxopyrimidin-5(4H)-ylidene)ethyl]pyridine-4-carbohydrazide
Smiles: OC1=NC(=O)/C(=C(/NNC(=O)c2ccncc2)\C)/C(=N1)O

STK852860
Synonyms: N-[(1Z)-1-{1-cyano-2-[(furan-2-ylmethyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]-4-methylbenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1)C)/C(=O)NCc1ccco1

STK852861
Synonyms: (1-hydroxy-1,4,5,6,7,8-hexahydrocyclohepta[d]imidazol-2-yl)[4-(3-methylbutoxy)phenyl]methanone
Smiles: CC(CCOc1ccc(cc1)C(=O)c1nc2c(n1O)CCCCC2)C

STK852862
Synonyms: 4-{[(4Z)-2-(4-methylphenyl)quinazolin-4(3H)-ylidene]amino}phenol
Smiles: Cc1ccc(cc1)c1nc2ccccc2/c(=N/c2ccc(cc2)O)/[nH]1

STK852863
Synonyms: 4-chloro-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(pyridin-3-ylmethyl)benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)N(Cc1cc2cccc(c2[nH]c1=O)C)Cc1cccnc1

STK852864
Synonyms: 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-[(2Z)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]acetamide
Smiles: O=C(/N=c\1/[nH]nc(s1)C(C)C)CN1C(=O)c2c(C1=O)cccc2

STK852865
Synonyms: 6,7-dimethyl-2-(5-methyl-1,2-oxazol-3-yl)-1-(3-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1cccc(c1)[N+](=O)[O-])c(=O)c1c(o2)cc(c(c1)C)C

STK852867
Synonyms: 1-benzyl-7-methyl-2-[(3-methylpiperidin-1-yl)carbonyl]pyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-4(1H)-one
Smiles: CC1CCCN(C1)C(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cc(cc1)C

STK852870
Synonyms: 4-[benzyl(methyl)amino]-1-methyl-3-nitroquinolin-2(1H)-one
Smiles: CN(c1c2ccccc2n(c(=O)c1[N+](=O)[O-])C)Cc1ccccc1

STK852872
Synonyms: 1-phenyl-2-(pyridin-3-ylmethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: O=C1N(Cc2cccnc2)C(c2c1oc1ccccc1c2=O)c1ccccc1

STK852873
Synonyms: (2Z)-2-(2-chloro-6-fluorobenzylidene)-3-oxo-7-(pyrrolidinium-1-ylmethyl)-2,3-dihydro-1-benzofuran-6-olate
Smiles: O=C1/C(=C/c2c(F)cccc2Cl)/Oc2c1ccc(c2C[NH+]1CCCC1)[O-]

STK852875
Synonyms: 3-chloro-N-methyl-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: Clc1cccc(c1)C(=O)N(Cc1cc2cc(C)ccc2[nH]c1=O)C

STK852877
Synonyms: 6-methyl-5-(3-methylbutyl)-2-[(3-methylphenyl)amino]pyrimidin-4-ol
Smiles: CC(CCc1c(C)nc(nc1O)Nc1cccc(c1)C)C

STK852878
Synonyms: (2Z)-3-oxo-2-(pyridin-4-ylmethylidene)-7-(pyrrolidinium-1-ylmethyl)-2,3-dihydro-1-benzofuran-6-olate
Smiles: O=C1/C(=C/c2ccncc2)/Oc2c1ccc(c2C[NH+]1CCCC1)[O-]

STK852881
Synonyms: (2E)-5-(4-chlorobenzyl)-2-[(2E)-(furan-2-ylmethylidene)hydrazinylidene]-2,5-dihydro-1,3-thiazol-4-ol
Smiles: Clc1ccc(cc1)CC1S/C(=N/N=C/c2ccco2)/N=C1O

STK852882
Synonyms: 1-(3-methoxypropyl)-4-oxo-N-(prop-2-en-1-yl)-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)NCC=C

STK852883
Synonyms: methyl{2-[(2-chloro-6-fluorobenzyl)amino]-7-hydroxy-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}acetate
Smiles: COC(=O)Cc1c(C)nc2n(c1O)nc(n2)NCc1c(F)cccc1Cl

STK852884
Synonyms: 1-benzyl-7-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: Cc1ccc2n(c1)c(=O)c1c(n2)n(c(c1)C(=O)Nc1cccc(c1)C(F)(F)F)Cc1ccccc1

STK852889
Synonyms: 5-(2,4-dichlorophenyl)-4-({(E)-[4-(diethylamino)-2-hydroxyphenyl]methylidene}amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCN(c1ccc(c(c1)O)/C=N/n1c(=S)[nH]nc1c1ccc(cc1Cl)Cl)CC

STK852894
Synonyms: (4Z)-4-{[(4-ethoxyphenyl)amino]methylidene}-2-(2-methoxyphenyl)isoquinoline-1,3(2H,4H)-dione
Smiles: CCOc1ccc(cc1)N/C=C\1/c2ccccc2C(=O)N(C1=O)c1ccccc1OC

STK852896
Synonyms: 4-[(furan-2-ylmethyl)amino]-1-methyl-3-nitroquinolin-2(1H)-one
Smiles: [O-][N+](=O)c1c(NCc2ccco2)c2ccccc2n(c1=O)C

STK852897
Synonyms: 2-(1-methyl-2,4-dioxo-9-phenyl-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl)acetohydrazide
Smiles: NNC(=O)Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccccc1

STK852901
Synonyms: N-(2-chlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-2-yl)propanamide
Smiles: O=C(Nc1ccccc1Cl)CCC1COc2c(O1)cccc2

STK852902
Synonyms: ethyl4-{[7-(2,4-dichlorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)Cc1nc2c(n1Cc1ccc(cc1Cl)Cl)c(=O)n(c(=O)n2C)C

STK852903
Synonyms: 8-{[4-(furan-2-ylcarbonyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(2-oxo-2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=C(c1ccccc1)Cn1c(CN2CCN(CC2)C(=O)c2ccco2)nc2c1c(=O)n(c(=O)n2C)C

STK852904
Synonyms: (2,5-dimethoxyphenyl)(1-hydroxy-1,4,5,6,7,8-hexahydrocyclohepta[d]imidazol-2-yl)methanone
Smiles: COc1ccc(c(c1)C(=O)c1nc2c(n1O)CCCCC2)OC

STK852905
Synonyms: 8-{[4-(furan-2-ylcarbonyl)piperazin-1-yl]methyl}-7-(2-methoxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCn1c(CN2CCN(CC2)C(=O)c2ccco2)nc2c1c(=O)n(c(=O)n2C)C

STK852906
Synonyms: 7-bromo-2-(5-methyl-1,2-oxazol-3-yl)-1-(4-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Brc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])c1noc(c1)C

STK852907
Synonyms: N-(1-tert-butyl-1H-benzimidazol-5-yl)butanamide
Smiles: CCCC(=O)Nc1ccc2c(c1)ncn2C(C)(C)C

STK852908
Synonyms: N,6-diethyl-2-methylthieno[2,3-d]pyrimidin-4-amine
Smiles: CCNc1nc(C)nc2c1cc(s2)CC

STK852910
Synonyms: 8-[4-(benzyloxy)-3-methoxyphenyl]-3-(furan-2-ylmethyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccc(c(c1)OC)OCc1ccccc1)Cc1ccco1

STK852911
Synonyms: 4-[3-(pyridin-4-yl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]benzenesulfonamide
Smiles: S=c1[nH]nc(n1c1ccc(cc1)S(=O)(=O)N)c1ccncc1

STK852913
Synonyms: 8-(furan-2-ylmethyl)-3-(3-hydroxypropyl)-1,6,7-trimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1c(n2)n(c(c1C)C)Cc1ccco1

STK852915
Synonyms: 3-(4-oxo-4-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}butyl)quinazolin-4(3H)-one
Smiles: O=C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)CCCn1cnc2c(c1=O)cccc2

STK852921
Synonyms: 8-(3-chloro-2-methylphenyl)-3-(3-hydroxypropyl)-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1cccc(c1C)Cl)C

STK852923
Synonyms: 3-benzyl-1-methyl-8-phenyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: O=c1n(C)c2nc3n(c2c(=O)n1Cc1ccccc1)CCN3c1ccccc1

STK852924
Synonyms: 1-(4-fluorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc(cc1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK852925
Synonyms: 7-methyl-2-(5-methyl-1,2-oxazol-3-yl)-1-[3-(prop-2-en-1-yloxy)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: C=CCOc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C

STK852926
Synonyms: N-(4-methoxyphenyl)-3-(5-methyl-2H-tetrazol-2-yl)tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Smiles: COc1ccc(cc1)NC(=O)C12CC3CC(C1)CC(C2)(C3)n1nnc(n1)C

STK852929
Synonyms: 8-(3-methoxyphenyl)-1,7-dimethyl-3-[2-(morpholin-4-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1cccc(c1)n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCOCC1

STK852931
Synonyms: 1-(2,5-dimethoxyphenyl)-7-fluoro-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc(cc1C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F)OC

STK852933
Synonyms: (2Z)-7-[(3-methylpiperidinium-1-yl)methyl]-2-(4-nitrobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CC1CCC[NH+](C1)Cc1c([O-])ccc2c1O/C(=C\c1ccc(cc1)[N+](=O)[O-])/C2=O

STK852934
Synonyms: 4-{[(E)-(2-chloro-6-fluorophenyl)methylidene]amino}-5-(2,4-dichlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1ccc(c(c1)Cl)c1n[nH]c(=S)n1/N=C/c1c(F)cccc1Cl

STK852935
Synonyms: 2,4-dihydroxy-1-(2-methoxyethyl)-5-(3-methoxyphenyl)-1,5-dihydro-6H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidin-6-one
Smiles: COCCn1c(O)nc(c2c1=NC1=C(C2c2cccc(c2)OC)C(=O)c2c1cccc2)O

STK852936
Synonyms: 7-fluoro-2-(pyridin-2-yl)-1-(pyridin-4-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccncc1)c1ccccn1

STK852939
Synonyms: 3-bromo-N-[(2Z)-6-methoxy-1,3-benzothiazol-2(3H)-ylidene]benzamide
Smiles: COc1ccc2c(c1)s/c(=N\C(=O)c1cccc(c1)Br)/[nH]2

STK852940
Synonyms: N-[3-(1H-imidazol-1-yl)propyl]-1-(3-methoxypropyl)-9-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)NCCCn1cncc1

STK852941
Synonyms: N-[(2Z)-3-(4-methoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methylpropanamide
Smiles: COc1ccc(cc1)N1/C(=N/C(=O)C(C)C)/SC2C1CS(=O)(=O)C2

STK852942
Synonyms: 8,8-dimethyl-4-[(2-methylpropyl)sulfanyl]-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
Smiles: CC(CSc1ncnc2c1oc1c2cc2c(n1)CC(OC2)(C)C)C

STK852947
Synonyms: (2Z)-2-(3-bromobenzylidene)-7-[(dimethylammonio)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: C[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cccc(c1)Br)/C2=O)C

STK852948
Synonyms: 8-(butan-2-ylamino)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCC(Nc1nc2c(n1CC(COc1ccccc1)O)c(=O)n(c(=O)n2C)C)C

STK852957
Synonyms: 4-(2,4,5-trimethoxyphenyl)-4,10-dihydro[1,3,5]triazino[1,2-a]benzimidazol-2-amine
Smiles: COc1cc(OC)c(cc1C1N=C(N)N=c2n1c1ccccc1[nH]2)OC

STK852958
Synonyms: N-tert-butyl-3-(2,3-dihydro-1,4-benzodioxin-2-yl)propanamide
Smiles: O=C(NC(C)(C)C)CCC1COc2c(O1)cccc2

STK852960
Synonyms: 4-(methoxycarbonyl)phenyl4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylate
Smiles: COC(=O)c1ccc(cc1)OC(=O)C12CCC(C2(C)C)(C(=O)O1)C

STK852962
Synonyms: methylN-(cyclohexylcarbamoyl)-D-valinate
Smiles: COC(=O)[C@@H](C(C)C)NC(=O)NC1CCCCC1

STK852963
Synonyms: 7-amino-2-methyl[1,2,4]triazolo[1,5-a]pyrimidin-5-ol
Smiles: Oc1cc(N)n2c(n1)nc(n2)C

STK852964
Synonyms: 9-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-fluorobenzyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COc1cc(CCN2CCCn3c2nc2c3c(=O)n(c(=O)n2C)Cc2ccccc2F)ccc1OC

STK852966
Synonyms: 2-chloro-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide
Smiles: Cc1ccc(cc1)c1noc(c1)NC(=O)c1ccccc1Cl

STK852967
Synonyms: (5E)-5-({1-[2-(2-chlorophenoxy)ethyl]-1H-indol-3-yl}methylidene)-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: OC1=NC(=O)N(C(=O)/C/1=C/c1cn(c2c1cccc2)CCOc1ccccc1Cl)Cc1ccco1

STK852968
Synonyms: 5-methyl-N-[2-(morpholin-4-yl)phenyl][1,2,4]triazolo[1,5-a]pyrimidin-7-amine
Smiles: Cc1cc(Nc2ccccc2N2CCOCC2)n2c(n1)ncn2

STK852969
Synonyms: N-(1,3-benzodioxol-5-yl)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)O1)C)Nc1ccc2c(c1)OCO2

STK852971
Synonyms: 1,6,7-trimethyl-3-(2-oxopropyl)-8-(2-phenylethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(=O)Cn1c(=O)c2n3c(C)c(n(c3nc2n(c1=O)C)CCc1ccccc1)C

STK852972
Synonyms: 1-ethyl-4-[(3-hydroxypropyl)amino]-3-nitroquinolin-2(1H)-one
Smiles: OCCCNc1c([N+](=O)[O-])c(=O)n(c2c1cccc2)CC

STK852973
Synonyms: N-[(2E)-5-({2-[(4-ethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylpropanamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1n[nH]/c(=N\C(=O)CCc2ccccc2)/s1

STK852974
Synonyms: 4-(4-methoxyphenoxy)-2-methyl[1]benzofuro[3,2-d]pyrimidine
Smiles: COc1ccc(cc1)Oc1nc(C)nc2c1oc1c2cccc1

STK852975
Synonyms: 2-({[3-methyl-4-(propan-2-yl)phenoxy]acetyl}amino)benzamide
Smiles: O=C(Nc1ccccc1C(=O)N)COc1ccc(c(c1)C)C(C)C

STK852984
Synonyms: 2-{[(5E)-5-(acetylimino)-4,5-dihydro-1,3,4-thiadiazol-2-yl]sulfanyl}-N-(dibenzo[b,d]furan-3-yl)acetamide
Smiles: O=C(Nc1ccc2c(c1)oc1c2cccc1)CSc1n[nH]/c(=N\C(=O)C)/s1

STK852989
Synonyms: N-(2-methoxyethyl)-1-(3-methoxypropyl)-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COCCNC(=O)c1cc2c(n1CCCOC)nc1n(c2=O)cccc1

STK852993
Synonyms: 8-(2,4-dimethoxyphenyl)-3-methyl-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1OC)OC)C

STK852997
Synonyms: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-imine5,5-dioxide
Smiles: N=C1SC2C(N1c1ccc3c(c1)OCCO3)CS(=O)(=O)C2

STK852998
Synonyms: 8-cyclohexyl-1,6,7-trimethyl-3-[2-(morpholin-4-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cn1c(=O)n(CCN2CCOCC2)c(=O)c2c1nc1n2c(c(n1C1CCCCC1)C)C

STK852999
Synonyms: 4-(2,4-dimethoxyphenyl)-3-phenyl-2,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: COc1cc(OC)ccc1C1CC(=O)Nc2c1c([nH]n2)c1ccccc1

STK853000
Synonyms: 3-(4-chlorobenzyl)-1-(pyridin-4-yl)pyrrolidine-2,5-dione
Smiles: Clc1ccc(cc1)CC1CC(=O)N(C1=O)c1ccncc1

STK853003
Synonyms: 8-(3-chloro-2-methylphenyl)-1-methyl-3-(prop-2-en-1-yl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: C=CCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1cccc(c1C)Cl

STK853004
Synonyms: 8-(5-methylfuran-2-yl)-3-(3-methylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccc(o1)C)c1cccc(c1)C

STK853005
Synonyms: 7-bromo-1-(3-methoxyphenyl)-2-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cccc(c1)C1N(C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Br

STK853008
Synonyms: methyl(8-cyclohexyl-1,7-dimethyl-2,4-dioxo-1,2,4,8-tetrahydro-3H-imidazo[2,1-f]purin-3-yl)acetate
Smiles: COC(=O)Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)C1CCCCC1)C

STK853010
Synonyms: N-carbamoyl-2-{(2E)-4-oxo-2-[(2E)-(1,7,7-trimethylbicyclo[2.2.1]hept-2-ylidene)hydrazinylidene]-1,3-thiazolidin-5-yl}acetamide
Smiles: O=C(NC(=O)N)CC1S/C(=N/N=C/2\CC3C(C2(C)CC3)(C)C)/NC1=O

STK853011
Synonyms: 2-{[(5E)-5-(acetylimino)-4,5-dihydro-1,3,4-thiadiazol-2-yl]sulfanyl}-N-(4-bromophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1n[nH]/c(=N\C(=O)C)/s1

STK853013
Synonyms: 1-(4-chlorophenyl)-4-(3,4-dimethoxyphenyl)-4,7-dihydrofuro[3,4-b]pyridine-2,5(1H,3H)-dione
Smiles: COc1ccc(cc1OC)C1CC(=O)N(C2=C1C(=O)OC2)c1ccc(cc1)Cl

STK853014
Synonyms: 5,7-dimethyl-4-oxo-N-[(2Z)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]-4H-chromene-2-carboxamide
Smiles: Cc1cc(C)c2c(c1)oc(cc2=O)C(=O)/N=c\1/[nH]nc(s1)C(C)C

STK853015
Synonyms: (6E)-6-[(4-ethylphenyl)imino]-4-(3-methyl-1-benzofuran-2-yl)-1,6-dihydro-1,3,5-triazin-2-amine
Smiles: CCc1ccc(cc1)/N=c/1\[nH]c(N)nc(n1)c1oc2c(c1C)cccc2

STK853017
Synonyms: N-[(2Z)-6-methoxy-1,3-benzothiazol-2(3H)-ylidene]-2-phenoxypropanamide
Smiles: COc1ccc2c(c1)s/c(=N\C(=O)C(Oc1ccccc1)C)/[nH]2

STK853018
Synonyms: (2Z)-2-(3-fluorobenzylidene)-3-oxo-7-(pyrrolidinium-1-ylmethyl)-2,3-dihydro-1-benzofuran-6-olate
Smiles: Fc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCCC1)[O-]

STK853019
Synonyms: N-(3-chlorophenyl)-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Smiles: O=C(Nc1cccc(c1)Cl)CCCn1nnc2c(c1=O)cccc2

STK853020
Synonyms: 5-[2-(3,4-dimethoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-ylidene]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1OC)C1CC(=C2C(=O)N(C)C(=O)N(C2=O)C)Nc2c(S1)cccc2

STK853024
Synonyms: 2-(4-fluorophenyl)-5-propyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: CCCc1[nH]n(c(=O)c1)c1ccc(cc1)F

STK853025
Synonyms: 3-(2-methoxyethyl)-8-(3-methoxyphenyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COCCn1c(=O)c2n3CCN(c3nc2n(c1=O)C)c1cccc(c1)OC

STK853026
Synonyms: 5-ethyl-2-(4-fluorophenyl)-2-methyl-4-phenyl-2,5-dihydro-1H-imidazol-1-ol3-oxide
Smiles: CCC1C(=[N+](C(N1O)(C)c1ccc(cc1)F)[O-])c1ccccc1

STK853029
Synonyms: methyl3-{2-[(4-methylphenyl)sulfanyl]ethyl}-4-oxo-2-sulfanyl-3,4-dihydroquinazoline-7-carboxylate
Smiles: COC(=O)c1ccc2c(c1)nc(n(c2=O)CCSc1ccc(cc1)C)S

STK853031
Synonyms: {4-[3-(2-methoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-yl}acetonitrile
Smiles: N#CCN1CCN(CC1)c1cc(C)nc2n1ncc2c1ccccc1OC

STK853032
Synonyms: 4-(4-methoxyphenyl)-8-methyl-2-[(4-methylphenyl)amino]-4,9-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Smiles: COc1ccc(cc1)C1N=C(Nc2ccc(cc2)C)N=c2n1c(=O)cc([nH]2)C

STK853033
Synonyms: (2E)-5-(3-nitrobenzyl)-2-(phenylimino)-2,5-dihydro-1,3-thiazol-4-ol
Smiles: OC1=N/C(=N\c2ccccc2)/SC1Cc1cccc(c1)[N+](=O)[O-]

STK853037
Synonyms: 2-(2,4-dichlorophenyl)-2,3-dihydro-1H-isoindol-1-imine
Smiles: Clc1ccc(c(c1)Cl)N1Cc2c(C1=N)cccc2

STK853039
Synonyms: 7-phenyl-10-(thiophen-2-yl)-3,4a,5,5a,8a,9,9a,10-octahydro-5,9-methano[1,3]thiazolo[5',4':5,6]thiopyrano[2,3-f]isoindole-2,6,8(7H)-trione
Smiles: O=c1sc2c([nH]1)SC1C(C2c2cccs2)C2CC1C1C2C(=O)N(C1=O)c1ccccc1

STK853040
Synonyms: 2-fluoro-N-[(2Z)-6-methoxy-1,3-benzothiazol-2(3H)-ylidene]benzamide
Smiles: COc1ccc2c(c1)s/c(=N\C(=O)c1ccccc1F)/[nH]2

STK853042
Synonyms: (4E)-1-(3-chlorophenyl)-4-[hydroxy(phenyl)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: Clc1cccc(c1)N1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1cccc(c1)[N+](=O)[O-]

STK853046
Synonyms: 3-chloro-N-[(3Z)-1-(2-methylpropyl)-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzamide
Smiles: Clc1cccc(c1)C(=O)/N=c/1\[nH]n(c2c1cc1ccccc1n2)CC(C)C

STK853047
Synonyms: 4-{[(E)-(5-bromo-2-fluorophenyl)methylidene]amino}-5-(pyridin-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Brc1ccc(c(c1)/C=N/n1c(=S)[nH]nc1c1cccnc1)F

STK853049
Synonyms: 3-(3-methylphenoxy)-8-[(2-methylpiperidinium-1-yl)methyl]-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate
Smiles: Cc1cccc(c1)Oc1c(=O)c2ccc(c(c2oc1C(F)(F)F)C[NH+]1CCCCC1C)[O-]

STK853051
Synonyms: 1-methyl-8-(4-methylphenyl)-3-(2-methylprop-2-en-1-yl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: CC(=C)Cn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccc(cc1)C

STK853052
Synonyms: 3-(3-hydroxypropyl)-1,6,7-trimethyl-8-(4-methylphenyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1c(n2)n(c(c1C)C)c1ccc(cc1)C

STK853054
Synonyms: 2-methyl-1-(3,4,5-trimethoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cc(cc(c1OC)OC)C1N(C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK853058
Synonyms: ethyl[(2Z)-2-{[(2-nitrophenoxy)acetyl]imino}-2,3-dihydro-1,3-thiazol-4-yl]acetate
Smiles: CCOC(=O)Cc1cs/c(=N\C(=O)COc2ccccc2[N+](=O)[O-])/[nH]1

STK853059
Synonyms: 7-methyl-2-(5-methyl-1,2-oxazol-3-yl)-1-(4-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])c1noc(c1)C

STK853060
Synonyms: N-{[(2E)-4-(4-methylphenyl)-1,3-thiazol-2(3H)-ylidene]carbamothioyl}naphthalene-2-carboxamide
Smiles: Cc1ccc(cc1)c1cs/c(=N/C(=S)NC(=O)c2ccc3c(c2)cccc3)/[nH]1

STK853061
Synonyms: 1-methyl-3-nitro-4-[(1-phenylethyl)amino]quinolin-2(1H)-one
Smiles: CC(c1ccccc1)Nc1c2ccccc2n(c(=O)c1[N+](=O)[O-])C

STK853069
Synonyms: 1-(3-methoxypropyl)-4-oxo-N-(1-phenylethyl)-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)NC(c1ccccc1)C

STK853070
Synonyms: 6-(2,4-dimethoxyphenyl)-N-(4-fluorophenyl)-2-hydroxy-4-methyl-1,6-dihydropyrimidine-5-carboxamide
Smiles: COc1cc(OC)ccc1C1NC(=NC(=C1C(=O)Nc1ccc(cc1)F)C)O

STK853074
Synonyms: 7-methyl-2-(5-methyl-1,2-oxazol-3-yl)-1-(pyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1ccccn1)c(=O)c1c(o2)ccc(c1)C

STK853077
Synonyms: N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(pyridin-3-ylmethyl)benzenesulfonamide
Smiles: Cc1ccc2c(c1)[nH]c(=O)c(c2)CN(S(=O)(=O)c1ccccc1)Cc1cccnc1

STK853078
Synonyms: 2-(3-chlorophenoxy)-N-[(2E)-4-phenyl-1,3-thiazol-2(3H)-ylidene]acetamide
Smiles: Clc1cccc(c1)OCC(=O)/N=c\1/scc([nH]1)c1ccccc1

STK853079
Synonyms: (5Z)-5-(4-hydroxy-3-methoxybenzylidene)-3-[methyl(phenyl)amino]-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1cc(ccc1O)/C=C/1\SC(=S)N(C1=O)N(c1ccccc1)C

STK853082
Synonyms: N-(4-chlorophenyl)-2-({5-[(4-methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1nnc(n1c1ccccc1)COc1ccc(cc1)C

STK853084
Synonyms: ethyl2-[(3-oxo-1,3-dihydro-2-benzofuran-1-yl)amino]benzoate
Smiles: CCOC(=O)c1ccccc1NC1OC(=O)c2c1cccc2

STK853085
Synonyms: methyl3-{[(2Z)-4-(2-ethoxy-2-oxoethyl)-1,3-thiazol-2(3H)-ylidene]carbamoyl}-5-nitrobenzoate
Smiles: CCOC(=O)Cc1cs/c(=N\C(=O)c2cc(cc(c2)C(=O)OC)[N+](=O)[O-])/[nH]1

STK853088
Synonyms: 2-(1,3-benzothiazol-2-yl)-4-chloro-5-[4-(3-chlorophenyl)piperazin-1-yl]pyridazin-3(2H)-one
Smiles: Clc1cccc(c1)N1CCN(CC1)c1cnn(c(=O)c1Cl)c1nc2c(s1)cccc2

STK853089
Synonyms: 2-(4-oxo-7,8,9,10-tetrahydropyrimido[4',5':4,5]furo[2,3-b]quinolin-3(4H)-yl)-N-(2-phenylethyl)acetamide
Smiles: O=C(Cn1cnc2c(c1=O)oc1c2cc2c(n1)CCCC2)NCCc1ccccc1

STK853090
Synonyms: 1,3-dimethyl-8-(4-methylpiperidin-1-yl)-7-[2-(pyrimidin-2-ylsulfanyl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CCN(CC1)c1nc2c(n1CCSc1ncccn1)c(=O)n(c(=O)n2C)C

STK853091
Synonyms: 8-(4-bromophenyl)-3-(3-hydroxypropyl)-1,6,7-trimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1c(n2)n(c(c1C)C)c1ccc(cc1)Br

STK853092
Synonyms: N-[(2Z)-6-(methylsulfonyl)-1,3-benzothiazol-2(3H)-ylidene]-2-phenylbutanamide
Smiles: CCC(C(=O)/N=c/1\sc2c([nH]1)ccc(c2)S(=O)(=O)C)c1ccccc1

STK853094
Synonyms: (4E)-1-(3-chloro-4-methylphenyl)-5-(4-hydroxyphenyl)-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione
Smiles: Oc1ccc(cc1)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1ccc(c(c1)Cl)C

STK853095
Synonyms: 3-[(2-methylquinolin-8-yl)amino]-2-benzofuran-1(3H)-one
Smiles: Cc1ccc2c(n1)c(ccc2)NC1OC(=O)c2c1cccc2

STK853100
Synonyms: 6,7-dimethyl-N-[(2Z)-5-(methylsulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxo-4H-chromene-2-carboxamide
Smiles: CSc1n[nH]/c(=N/C(=O)c2cc(=O)c3c(o2)cc(c(c3)C)C)/s1

STK853103
Synonyms: (5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)[4-(4-methoxyphenyl)piperazin-1-yl]methanone
Smiles: COc1ccc(cc1)N1CCN(CC1)C(=O)c1nn2c(n1)nc(cc2C)C

STK853107
Synonyms: N-(3-bromophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)ethanediamide
Smiles: Brc1cccc(c1)NC(=O)C(=O)NCC1COc2c(O1)cccc2

STK853109
Synonyms: 7-methyl-2-(5-methyl-1,2-oxazol-3-yl)-1-[3-(propan-2-yloxy)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CC(Oc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C)C

STK853112
Synonyms: 8-benzyl-1,7-dimethyl-3-[2-(morpholin-4-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cn1c(=O)n(CCN2CCOCC2)c(=O)c2c1nc1n2cc(n1Cc1ccccc1)C

STK853113
Synonyms: N-[3-(1,3-benzodioxol-5-yl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])Nc1oc2ccccc2c(=O)c1c1ccc2c(c1)OCO2

STK853114
Synonyms: N-(3-acetylphenyl)-6-(4-oxoquinazolin-3(4H)-yl)hexanamide
Smiles: O=C(Nc1cccc(c1)C(=O)C)CCCCCn1cnc2c(c1=O)cccc2

STK853115
Synonyms: 8-[2-(3,4-dimethoxyphenyl)ethyl]-1,6,7-trimethyl-3-(3-methylbutyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1cc(ccc1OC)CCn1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)CCC(C)C

STK853117
Synonyms: N-[2-(acetylamino)-5-methylphenyl]-3-(2,3-dihydro-1,4-benzodioxin-2-yl)propanamide
Smiles: O=C(Nc1cc(C)ccc1NC(=O)C)CCC1COc2c(O1)cccc2

STK853120
Synonyms: (6Z)-6-[(4-methoxyphenyl)imino]-4-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-1,6-dihydro-1,3,5-triazin-2-amine
Smiles: COc1ccc(cc1)/N=c/1\nc(CSc2nnnn2C)nc([nH]1)N

STK853122
Synonyms: N-(4-methoxyphenyl)-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: COc1ccc(cc1)N(S(=O)(=O)c1ccccc1)Cc1cc2cccc(c2[nH]c1=O)C

STK853123
Synonyms: 3-(4-methoxyphenyl)-4-(2-nitrophenyl)-5-phenyl-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COc1ccc(cc1)c1[nH]nc2c1C(c1ccccc1[N+](=O)[O-])N(C2=O)c1ccccc1

STK853127
Synonyms: 1-(3-methoxypropyl)-8-methyl-2,5-dioxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile
Smiles: COCCCn1c(=O)c(C#N)cc2c1nc1ccc(cn1c2=O)C

STK853131
Synonyms: 9-(4-fluorophenyl)-1,3-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Fc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)C

STK853132
Synonyms: 4-(4-methoxyphenoxy)-N-[(2Z)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Smiles: COc1ccc(cc1)OCCCC(=O)/N=c\1/[nH]nc(s1)C

STK853139
Synonyms: N-(4-chloro-2-methylphenyl)-2-{[5-(2-fluorophenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2C)Cl)nnc1c1ccccc1F

STK853144
Synonyms: (6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)(thiophen-2-yl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1cccs1

STK853145
Synonyms: 2-(2-fluorophenyl)-3-(3-methoxypropyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: COCCCn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)c1ccccc1F

STK853146
Synonyms: 7-(1H-imidazol-1-yl)-3-phenyl-5-(propan-2-yl)pyrazolo[1,5-a]pyrimidine
Smiles: CC(c1nc2c(cnn2c(c1)n1cncc1)c1ccccc1)C

STK853147
Synonyms: 4-methoxy-N-[(2Z)-6-methoxy-1,3-benzothiazol-2(3H)-ylidene]-3-nitrobenzamide
Smiles: COc1ccc2c(c1)s/c(=N\C(=O)c1ccc(c(c1)[N+](=O)[O-])OC)/[nH]2

STK853151
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(4-chlorophenyl)-4,7-dihydrofuro[3,4-b]pyridine-2,5(1H,3H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)CC(C2=C1COC2=O)c1ccc2c(c1)OCO2

STK853155
Synonyms: (2E)-2-(4-hydroxyquinazolin-2-yl)-3-(2-iodophenyl)prop-2-enenitrile
Smiles: N#C/C(=C\c1ccccc1I)/c1nc(O)c2c(n1)cccc2

STK853157
Synonyms: 3-(but-3-en-2-yl)-1-methyl-8-(4-methylphenyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: C=CC(n1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccc(cc1)C)C

STK853158
Synonyms: N-[(2E)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]-4-nitrobenzamide
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])/N=c/1\[nH]nc(s1)C

STK853160
Synonyms: (2Z)-7-{[bis(2-methoxyethyl)ammonio]methyl}-2-(3-bromobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: COCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cccc(c1)Br)/C2=O)CCOC

STK853163
Synonyms: 4-(4-hydroxy-3,5-dimethoxyphenyl)-1-phenyl-4,7-dihydrofuro[3,4-b]pyridine-2,5(1H,3H)-dione
Smiles: COc1cc(cc(c1O)OC)C1CC(=O)N(C2=C1C(=O)OC2)c1ccccc1

STK853164
Synonyms: 3-(4-fluorobenzyl)-1,7-dimethyl-8-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Fc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1ccccc1)C

STK853166
Synonyms: 4-({[5-(2-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Smiles: N#Cc1ccc(cc1)CSc1nnc(n1c1ccccc1)c1ccccc1F

STK853167
Synonyms: 3-(4-methylphenyl)-6-oxo-8-(3,4,5-trimethoxyphenyl)-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1cc(OC)c(c(c1)OC)OC)c1ccc(cc1)C

STK853168
Synonyms: N-butyl-N,8,8-trimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-4-amine
Smiles: CCCCN(c1ncnc2c1oc1c2cc2c(n1)CC(OC2)(C)C)C

STK853169
Synonyms: ethyl2-amino-4-(3,4-difluorophenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c(C1c1ccc(c(c1)F)F)oc(cc2=O)CO

STK853171
Synonyms: 4-({[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Smiles: N#Cc1ccc(cc1)CSc1nnc(n1Cc1ccco1)COc1ccccc1

STK853172
Synonyms: 3-[3-(3-ethoxy-4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-methylpropanamide
Smiles: CCOc1cc(ccc1OC)c1noc(n1)CCC(=O)NC

STK853176
Synonyms: 8-(4-chlorophenyl)-3-(2-methoxyethyl)-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COCCn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1ccc(cc1)Cl)C

STK853178
Synonyms: 2-{[(5Z)-5-(acetylimino)-4,5-dihydro-1,3,4-thiadiazol-2-yl]sulfanyl}-N-(4-acetylphenyl)butanamide
Smiles: CCC(C(=O)Nc1ccc(cc1)C(=O)C)Sc1n[nH]/c(=N/C(=O)C)/s1

STK853180
Synonyms: N-[(3Z)-1-butyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzenesulfonamide
Smiles: CCCCn1[nH]/c(=N\S(=O)(=O)c2ccccc2)/c2c1nc1ccccc1c2

STK853181
Synonyms: N-(3,4-dichlorophenyl)-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)CCCn1nnc2c(c1=O)cccc2

STK853182
Synonyms: 8-chloro-7-(2-hydroxy-2-phenylethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(c1ccccc1)Cn1c(Cl)nc2c1c(=O)n(C)c(=O)n2C

STK853183
Synonyms: 1-(3-fluorophenyl)-4-(4-hydroxy-3-methoxyphenyl)-4,7-dihydrofuro[3,4-b]pyridine-2,5(1H,3H)-dione
Smiles: COc1cc(ccc1O)C1CC(=O)N(C2=C1C(=O)OC2)c1cccc(c1)F

STK853184
Synonyms: 4-bromo-N-[(4Z)-2-(4-nitrophenyl)quinazolin-4(3H)-ylidene]aniline
Smiles: Brc1ccc(cc1)/N=c/1\[nH]c(nc2c1cccc2)c1ccc(cc1)[N+](=O)[O-]

STK853185
Synonyms: (4E)-4-[hydroxy(phenyl)methylidene]-1-(3-methoxyphenyl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)N1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1cccc(c1)[N+](=O)[O-]

STK853187
Synonyms: 2-(1,3-benzodioxol-5-yl)-2,3-dihydro-4H-1,3-benzoxazin-4-one
Smiles: O=C1NC(Oc2c1cccc2)c1ccc2c(c1)OCO2

STK853188
Synonyms: (2Z)-7-[(dipropylammonio)methyl]-3-oxo-2-(pyridin-4-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1ccncc1)/C2=O)CCC

STK853189
Synonyms: 4-(2,4-dimethylphenyl)-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1ccc(c(c1)C)n1c(=S)[nH]nc1c1ccncc1

STK853190
Synonyms: 8,8-dimethyl-4-(2-methylpiperidin-1-yl)-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
Smiles: CC1CCCCN1c1ncnc2c1oc1c2cc2c(n1)CC(OC2)(C)C

STK853193
Synonyms: 1-(5-methyl-1,2-oxazol-3-yl)-3-(1-phenylethyl)pyrrolidine-2,5-dione
Smiles: O=C1CC(C(=O)N1c1noc(c1)C)C(c1ccccc1)C

STK853196
Synonyms: methyl3-[1,6,7-trimethyl-2,4-dioxo-8-(2-phenylethyl)-1,2,4,8-tetrahydro-3H-imidazo[2,1-f]purin-3-yl]propanoate
Smiles: COC(=O)CCn1c(=O)n(C)c2c(c1=O)n1c(n2)n(c(c1C)C)CCc1ccccc1

STK853197
Synonyms: (2Z)-7-{[bis(2-methylpropyl)ammonio]methyl}-3-oxo-2-(pyridin-3-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: CC(C[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cccnc1)/C2=O)CC(C)C)C

STK853199
Synonyms: 5-bromo-N-[4-(methylsulfamoyl)phenyl]furan-2-carboxamide
Smiles: CNS(=O)(=O)c1ccc(cc1)NC(=O)c1ccc(o1)Br

STK853200
Synonyms: 3-(1H-benzimidazol-2-yl)-N-(2-phenylethyl)propanamide
Smiles: O=C(CCc1nc2c([nH]1)cccc2)NCCc1ccccc1

STK853202
Synonyms: 3-(2-fluorobenzyl)-8-(furan-2-ylmethyl)-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Fc1ccccc1Cn1c(=O)c2n3cc(n(c3nc2n(c1=O)C)Cc1ccco1)C

STK853204
Synonyms: methyl3-[1,7-dimethyl-2,4-dioxo-8-(2-phenylethyl)-1,2,4,8-tetrahydro-3H-imidazo[2,1-f]purin-3-yl]propanoate
Smiles: COC(=O)CCn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)CCc1ccccc1)C

STK853209
Synonyms: N-(3,5-dimethoxyphenyl)-6-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)hexanamide
Smiles: COc1cc(NC(=O)CCCCCn2nnc3c(c2=O)cccc3)cc(c1)OC

STK853210
Synonyms: (2Z)-7-(azepanium-1-ylmethyl)-2-(4-nitrobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: O=C1/C(=C/c2ccc(cc2)[N+](=O)[O-])/Oc2c1ccc(c2C[NH+]1CCCCCC1)[O-]

STK853211
Synonyms: 8-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-dimethyl-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCn1c(CN2CC(C)OC(C2)C)nc2c1c(=O)n(c(=O)n2C)C

STK853212
Synonyms: 5-(4-chlorophenyl)-4-({(E)-[2-hydroxy-3-(prop-2-en-1-yl)phenyl]methylidene}amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: C=CCc1cccc(c1O)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)Cl

STK853213
Synonyms: 2-[7-(2-chlorophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]-5-methoxyphenol
Smiles: COc1ccc(c(c1)O)c1nn2c(n1)c1cnn(c1nc2)c1ccccc1Cl

STK853214
Synonyms: 6-chloro-8-[(diethylammonio)methyl]-4-methyl-2-oxo-2H-chromen-7-olate
Smiles: CC[NH+](Cc1c([O-])c(Cl)cc2c1oc(=O)cc2C)CC

STK853215
Synonyms: N-(4-ethoxyphenyl)-N-[(6-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)methyl]methanesulfonamide
Smiles: CCOc1ccc(cc1)N(S(=O)(=O)C)Cc1cc2cc(OC)ccc2[nH]c1=O

STK853217
Synonyms: 3,4,5-trimethoxy-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-propylbenzamide
Smiles: CCCN(C(=O)c1cc(OC)c(c(c1)OC)OC)Cc1cc2ccccc2[nH]c1=O

STK853218
Synonyms: N-(2-methoxyphenyl)-2-(4-oxo-7,8,9,10-tetrahydropyrimido[4',5':4,5]furo[2,3-b]quinolin-3(4H)-yl)acetamide
Smiles: COc1ccccc1NC(=O)Cn1cnc2c(c1=O)oc1c2cc2c(n1)CCCC2

STK853221
Synonyms: 1-ethyl-4-{[3-(1H-imidazol-1-yl)propyl]amino}-3-nitroquinolin-2(1H)-one
Smiles: CCn1c2ccccc2c(c(c1=O)[N+](=O)[O-])NCCCn1cncc1

STK853222
Synonyms: 6-ethyl-2-methyl-4-(piperidin-1-yl)thieno[2,3-d]pyrimidine
Smiles: CCc1cc2c(s1)nc(nc2N1CCCCC1)C

STK853223
Synonyms: ethyl2-[(2Z)-1,3-benzoxazol-2(3H)-ylideneamino]-4-methyl-6-propylpyrimidine-5-carboxylate
Smiles: CCOC(=O)c1c(C)nc(nc1CCC)/N=c/1\oc2c([nH]1)cccc2

STK853226
Synonyms: N-(furan-2-ylmethyl)-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-4-amine
Smiles: CC1(C)OCc2c(C1)nc1c(c2)c2c(o1)c(ncn2)NCc1ccco1

STK853228
Synonyms: N-(3-chlorophenyl)-3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide
Smiles: O=C(Nc1cccc(c1)Cl)CCn1nnc2c(c1=O)cccc2

STK853229
Synonyms: (2Z)-3-oxo-2-[(2E)-3-phenylprop-2-en-1-ylidene]-7-(pyrrolidinium-1-ylmethyl)-2,3-dihydro-1-benzofuran-6-olate
Smiles: O=C1/C(=C/C=C/c2ccccc2)/Oc2c1ccc(c2C[NH+]1CCCC1)[O-]

STK853232
Synonyms: N-[4-(propylsulfamoyl)phenyl]pyridine-2-carboxamide
Smiles: CCCNS(=O)(=O)c1ccc(cc1)NC(=O)c1ccccn1

STK853233
Synonyms: (6E)-6-[(2,5-dimethoxyphenyl)imino]-4-({[5-(pyridin-4-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-1,6-dihydro-1,3,5-triazin-2-amine
Smiles: COc1ccc(c(c1)/N=c\1/nc(CSc2nnc(o2)c2ccncc2)nc([nH]1)N)OC

STK853238
Synonyms: 2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-3H-benzo[f]chromen-3-one
Smiles: COc1ccc(cc1)c1scc(n1)c1cc2c(oc1=O)ccc1c2cccc1

STK853241
Synonyms: 1-methyl-8-(2-methylphenyl)-3-(prop-2-en-1-yl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: C=CCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccccc1C

STK853243
Synonyms: (4E)-5-(4-chlorophenyl)-1-(2-hydroxyethyl)-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione
Smiles: OCCN1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccc(cc1)Cl

STK853245
Synonyms: N-[(2Z)-5-[(3-acetyl-2,4,6-trimethylbenzyl)sulfanyl]-1,3,4-thiadiazol-2(3H)-ylidene]-2-methoxybenzamide
Smiles: COc1ccccc1C(=O)/N=c\1/[nH]nc(s1)SCc1c(C)cc(c(c1C)C(=O)C)C

STK853248
Synonyms: 3-(2,6-dichlorobenzyl)-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-4(3H)-one
Smiles: Clc1cccc(c1Cn1cnc2c(c1=O)oc1c2cc2c(n1)CC(OC2)(C)C)Cl

STK853250
Synonyms: (2E)-3-(4-ethoxyphenyl)-2-(4-hydroxyquinazolin-2-yl)prop-2-enenitrile
Smiles: CCOc1ccc(cc1)/C=C(/c1nc(O)c2c(n1)cccc2)\C#N

STK853251
Synonyms: 2-{[4-(4-methoxyphenyl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}phthalazin-1(2H)-one
Smiles: COc1ccc(cc1)n1c(=S)[nH]nc1Cn1ncc2c(c1=O)cccc2

STK853252
Synonyms: 2-ethyl-1-(4-fluorophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCN1C(=O)c2c(C1c1ccc(cc1)F)c(=O)c1c(o2)cccc1

STK853253
Synonyms: 2-[(8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: NC(=O)CSc1ncnc2c1oc1c2cc2c(n1)CC(OC2)(C)C

STK853254
Synonyms: 7-fluoro-1-(2-methoxyphenyl)-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccccc1C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK853256
Synonyms: [4-(3-methyl-5-phenyl-1H-pyrazol-1-yl)phenyl][4-(pyrimidin-2-yl)piperazin-1-yl]methanone
Smiles: Cc1cc(n(n1)c1ccc(cc1)C(=O)N1CCN(CC1)c1ncccn1)c1ccccc1

STK853257
Synonyms: N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(pyridin-3-ylmethyl)thiophene-2-carboxamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(=O)c1cccs1)Cc1cccnc1

STK853259
Synonyms: 5-tert-butyl-3-(4-chlorophenyl)-2-methyl-7-(2-methyl-1H-imidazol-1-yl)pyrazolo[1,5-a]pyrimidine
Smiles: Clc1ccc(cc1)c1c(C)nn2c1nc(cc2n1ccnc1C)C(C)(C)C

STK853263
Synonyms: (2E)-N-[(2Z)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]-3-(3-nitrophenyl)prop-2-enamide
Smiles: O=C(/N=c\1/[nH]nc(s1)C)/C=C/c1cccc(c1)[N+](=O)[O-]

STK853264
Synonyms: 1,3-dimethyl-8-(4-phenylpiperazin-1-yl)-7-[2-(pyrimidin-2-ylsulfanyl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1n(C)c2nc(n(c2c(=O)n1C)CCSc1ncccn1)N1CCN(CC1)c1ccccc1

STK853266
Synonyms: 7-butyl-8-{[4-(furan-2-ylcarbonyl)piperazin-1-yl]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCn1c(CN2CCN(CC2)C(=O)c2ccco2)nc2c1c(=O)n(c(=O)n2C)C

STK853268
Synonyms: (2Z)-2-[(5-methylfuran-2-yl)methylidene]-3-oxo-7-(pyrrolidinium-1-ylmethyl)-2,3-dihydro-1-benzofuran-6-olate
Smiles: Cc1ccc(o1)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCCC1)[O-]

STK853269
Synonyms: 4-[4-(4-methoxyphenyl)piperazin-1-yl]-1-methyl-3-nitroquinolin-2(1H)-one
Smiles: COc1ccc(cc1)N1CCN(CC1)c1c([N+](=O)[O-])c(=O)n(c2c1cccc2)C

STK853270
Synonyms: 8-[(2,6-dimethylmorpholin-4-yl)methyl]-7-(4-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1OC(C)CN(C1)Cc1nc2c(n1Cc1ccc(cc1)F)c(=O)n(c(=O)n2C)C

STK853272
Synonyms: 2-{[5-(2-methylfuran-3-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-[(2Z)-4-phenyl-1,3-thiazol-2(3H)-ylidene]acetamide
Smiles: O=C(/N=c/1\scc([nH]1)c1ccccc1)CSc1nnc(o1)c1ccoc1C

STK853276
Synonyms: 3-(3-chlorophenyl)-2-hydroxy-7-[(3-nitrobenzyl)sulfanyl]pyrimido[4,5-d]pyrimidin-4(3H)-one
Smiles: Clc1cccc(c1)n1c(O)nc2c(c1=O)cnc(n2)SCc1cccc(c1)[N+](=O)[O-]

STK853277
Synonyms: (5E)-5-benzylidene-4-hydroxy-1,3-thiazole-2(5H)-thione
Smiles: OC1=NC(=S)S/C/1=C/c1ccccc1

STK853278
Synonyms: (2Z)-2-(furan-2-ylmethylidene)-7-[(4-methylpiperidinium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CC1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1ccco1)/C2=O

STK853280
Synonyms: (4E)-1-(5-bromopyridin-2-yl)-4-[(4-chlorophenyl)(hydroxy)methylidene]-5-(4-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1c1ccc(cn1)Br

STK853281
Synonyms: 8-(azepan-1-yl)-1,3-dimethyl-7-{2-[(4-methylpyrimidin-2-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccnc(n1)SCCn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCCCC1

STK853283
Synonyms: 4-(4-hydroxy-3-methoxyphenyl)-3-(2-hydroxyphenyl)-5-(2-methoxyethyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COCCN1C(=O)c2c(C1c1ccc(c(c1)OC)O)c([nH]n2)c1ccccc1O

STK853285
Synonyms: N-benzyl-2-methyl-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]propanamide
Smiles: CC(C(=O)N(Cc1cc2cccc(c2[nH]c1=O)C)Cc1ccccc1)C

STK853288
Synonyms: methyl2-cyano-3-(5-hydroxy-3-methyl-1H-pyrazol-4-yl)-3-(pyridin-3-yl)propanoate
Smiles: N#CC(C(c1c(O)[nH]nc1C)c1cccnc1)C(=O)OC

STK853289
Synonyms: methyl[9-(4-methoxyphenyl)-1,7-dimethyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate
Smiles: COC(=O)Cn1c(=O)c2n3CC(C)CN(c3nc2n(c1=O)C)c1ccc(cc1)OC

STK853292
Synonyms: (6E)-6-(1,3-benzodioxol-5-ylmethylidene)-7-imino-2-methyl-6,7-dihydro-5H-[1,2]oxazolo[2,3-a]pyrimidin-5-one
Smiles: Cc1on2c(=NC(=O)/C(=C/c3ccc4c(c3)OCO4)/C2=N)c1

STK853294
Synonyms: 1-(2-fluorophenyl)-3-[(2Z)-5-{[4-(2-phenylpropan-2-yl)phenoxy]methyl}-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: O=C(Nc1ccccc1F)/N=c\1/[nH]nc(s1)COc1ccc(cc1)C(c1ccccc1)(C)C

STK853295
Synonyms: 1-(4-bromophenyl)-5-[(2-methoxyphenoxy)methyl]-1H-tetrazole
Smiles: COc1ccccc1OCc1nnnn1c1ccc(cc1)Br

STK853298
Synonyms: 2-(3-tert-butyl-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)-N-(furan-2-ylmethyl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1C(C)(C)C)NCc1ccco1

STK853299
Synonyms: 5-(biphenyl-4-yl)-2-(4-methylphenyl)-4-phenyl-1H-imidazole
Smiles: Cc1ccc(cc1)c1nc(c([nH]1)c1ccc(cc1)c1ccccc1)c1ccccc1

STK853301
Synonyms: 4-phenyl-5-(thiophen-2-yl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazole
Smiles: COc1c(OC)cc(cc1OC)c1[nH]c(c(n1)c1ccccc1)c1cccs1

STK853303
Synonyms: 10-(3,4-dichlorophenyl)-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione
Smiles: Clc1cc(ccc1Cl)n1c2ccccc2cc2c1nc(=O)n(c2=O)C

STK853305
Synonyms: methyl2-{(3E)-2-(3-chlorophenyl)-3-[(4-fluorophenyl)(hydroxy)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)F)/O)/C1c1cccc(c1)Cl

STK853306
Synonyms: 1,7-dimethyl-3-[2-(morpholin-4-yl)ethyl][1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: Cc1oc2n(c1)c1c(n2)n(C)c(=O)n(c1=O)CCN1CCOCC1

STK853308
Synonyms: 1-(3-chlorophenyl)-3-[(2Z)-5-(3-propoxyphenyl)-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: CCCOc1cccc(c1)c1n[nH]/c(=N/C(=O)Nc2cccc(c2)Cl)/s1

STK853309
Synonyms: N-[(2Z)-5-benzyl-1,3,4-thiadiazol-2(3H)-ylidene]-4-fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)/N=c\1/[nH]nc(s1)Cc1ccccc1

STK853310
Synonyms: 1,6,7,8-tetramethyl-3-(2-phenylethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: O=c1n(CCc2ccccc2)c(=O)c2c(n1C)nc1n2c(C)c(n1C)C

STK853315
Synonyms: (2Z)-7-[(dimethylammonio)methyl]-4-methyl-3-oxo-2-(pyridin-4-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: C[NH+](Cc1c([O-])cc(c2c1O/C(=C\c1ccncc1)/C2=O)C)C

STK853317
Synonyms: (4E)-4-[hydroxy(phenyl)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-phenylpyrrolidine-2,3-dione
Smiles: Cc1nnc(s1)N1C(c2ccccc2)/C(=C(/c2ccccc2)\O)/C(=O)C1=O

STK853318
Synonyms: (2Z)-7-[(4-ethylpiperazin-1-ium-1-yl)methyl]-4-methyl-3-oxo-2-(pyridin-3-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCN1CC[NH+](CC1)Cc1c([O-])cc(c2c1O/C(=C\c1cccnc1)/C2=O)C

STK853319
Synonyms: 6-iodo-3-(4-methylphenyl)-2-(prop-2-en-1-ylsulfanyl)quinazolin-4(3H)-one
Smiles: C=CCSc1nc2ccc(cc2c(=O)n1c1ccc(cc1)C)I

STK853321
Synonyms: (4E)-5-(3,4-dichlorophenyl)-4-[hydroxy(thiophen-2-yl)methylidene]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1ccc(c(c1)Cl)Cl)Cc1cccnc1)/c1cccs1

STK853322
Synonyms: 6-methoxy-2-[3-(morpholin-4-yl)propyl]-1-(pyridin-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)C(N(C1=O)CCCN1CCOCC1)c1cccnc1

STK853323
Synonyms: 2-{[2-(ethylsulfanyl)-7,7-dimethyl-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidin-4-yl]amino}ethanol
Smiles: OCCNc1nc(SCC)nc2c1sc1c2COC(C1)(C)C

STK853324
Synonyms: 1-{2-[3-(prop-1-en-2-yl)phenyl]propan-2-yl}-3-tricyclo[3.3.1.1~3,7~]dec-1-ylurea
Smiles: O=C(NC(c1cccc(c1)C(=C)C)(C)C)NC12CC3CC(C2)CC(C1)C3

STK853326
Synonyms: 7,8-dimethoxy-4-methyl-3-[2-oxo-2-(piperidin-1-yl)ethyl]-2H-chromen-2-one
Smiles: COc1c(OC)ccc2c1oc(=O)c(c2C)CC(=O)N1CCCCC1

STK853328
Synonyms: 7-(4-methoxyphenyl)-6-(4-methylphenyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: COc1ccc(cc1)C1n2ncnc2NC2=C1C(Oc1c2cccc1)c1ccc(cc1)C

STK853329
Synonyms: 4-[2-(5-fluoro-2-methoxyphenyl)-2-oxoethyl]-2-(propan-2-yl)-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: COc1ccc(cc1C(=O)CN1C(=O)C(Oc2c(C1=O)cccc2)C(C)C)F

STK853330
Synonyms: (4E)-4-{hydroxy[3-methyl-4-(2-methylpropoxy)phenyl]methylidene}-1-(2-methoxyethyl)-5-phenylpyrrolidine-2,3-dione
Smiles: COCCN1C(c2ccccc2)/C(=C(/c2ccc(c(c2)C)OCC(C)C)\O)/C(=O)C1=O

STK853333
Synonyms: 2-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]-1H-isoindole-1,3(2H)-dione
Smiles: O=C(N1CCN(CC1)c1ccccc1)CCN1C(=O)c2c(C1=O)cccc2

STK853335
Synonyms: (2Z)-2-(4-methoxybenzylidene)-4-methyl-3-oxo-7-(pyrrolidinium-1-ylmethyl)-2,3-dihydro-1-benzofuran-6-olate
Smiles: COc1ccc(cc1)/C=C/1\Oc2c(C1=O)c(C)cc(c2C[NH+]1CCCC1)[O-]

STK853337
Synonyms: (4E)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-5-(pyridin-3-yl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Smiles: CC(Oc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)Cc1cccnc1)/O)C

STK853340
Synonyms: 1,7-dimethyl-3-(2-methylpropyl)[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: CC(Cn1c(=O)n(C)c2c(c1=O)n1cc(oc1n2)C)C

STK853341
Synonyms: (4E)-5-(4-tert-butylphenyl)-4-[hydroxy(4-methoxyphenyl)methylidene]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(C)(C)C)Cc1cccnc1)/O

STK853344
Synonyms: (4E)-5-(4-fluorophenyl)-4-[hydroxy(5-methylfuran-2-yl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: Fc1ccc(cc1)C1/C(=C(/c2ccc(o2)C)\O)/C(=O)C(=O)N1c1noc(c1)C

STK853345
Synonyms: 3-(4-fluorobenzyl)-8-(4-methoxybenzyl)-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1ccc(cc1)Cn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1)F

STK853346
Synonyms: 4-ethyl-N-{3-[(tetrahydrofuran-2-ylmethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-1,2,3-thiadiazole-5-carboxamide
Smiles: CCc1nnsc1C(=O)Nc1sc2c(c1C(=O)NCC1CCCO1)CCCC2

STK853347
Synonyms: 6-(3,4-dimethoxyphenyl)-7-(4-fluorophenyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: COc1cc(ccc1OC)C1Oc2ccccc2C2=C1C(c1ccc(cc1)F)n1c(N2)ncn1

STK853348
Synonyms: 3-[(4-fluorophenyl)amino]-6-methyl-1,2,4-triazin-5-ol
Smiles: Fc1ccc(cc1)Nc1nnc(c(n1)O)C

STK853351
Synonyms: (5E)-5-{[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene}-3-(3,5-dimethylphenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: Cc1cc(C)cc(c1)N1C(=O)N=C(/C(=C\c2ccc(o2)c2ccc(cc2Cl)[N+](=O)[O-])/C1=O)O

STK853352
Synonyms: 2-[(5-bromo-2-oxo-1-propyl-2,3-dihydro-1H-indol-3-yl)methyl]-3-methylquinazolin-4(3H)-one
Smiles: CCCN1C(=O)C(c2c1ccc(c2)Br)Cc1nc2ccccc2c(=O)n1C

STK853354
Synonyms: 2-{[7,7-dimethyl-2-(4-methylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CSc1nc(nc2c1COC(C2)(C)C)c1ccc(cc1)C

STK853355
Synonyms: N-benzyl-2-(1,6,6-trimethyl-2,4-dioxo-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)acetamide
Smiles: O=C(Cn1c(=O)c2c3CC(C)(C)OCc3sc2n(c1=O)C)NCc1ccccc1

STK853360
Synonyms: (4E)-1-(6-ethyl-1,3-benzothiazol-2-yl)-5-(furan-2-yl)-4-[hydroxy(thiophen-2-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CCc1ccc2c(c1)sc(n2)N1C(c2ccco2)/C(=C(/c2cccs2)\O)/C(=O)C1=O

STK853362
Synonyms: 1-(4-bromophenyl)-5-[(4-methylphenoxy)methyl]-1H-tetrazole
Smiles: Cc1ccc(cc1)OCc1nnnn1c1ccc(cc1)Br

STK853363
Synonyms: N-[(2Z)-6-[(phenoxyacetyl)amino]-1,3-benzothiazol-2(3H)-ylidene]butanamide
Smiles: CCCC(=O)/N=c\1/[nH]c2c(s1)cc(cc2)NC(=O)COc1ccccc1

STK853364
Synonyms: 9-(2-methoxyphenyl)-1,3,7-trimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COc1ccccc1N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)C

STK853367
Synonyms: 1-[(2Z)-5-{[(4-fluorobenzyl)sulfanyl]methyl}-1,3,4-thiadiazol-2(3H)-ylidene]-3-(3-methoxyphenyl)urea
Smiles: COc1cccc(c1)NC(=O)/N=c\1/[nH]nc(s1)CSCc1ccc(cc1)F

STK853368
Synonyms: (5E)-5-(3,4-dihydroxybenzylidene)-1-(prop-2-en-1-yl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: C=CCN1C(=NC(=O)/C(=C\c2ccc(c(c2)O)O)/C1=O)S

STK853372
Synonyms: ethyl4-(2,5-dimethyl-3-{(E)-[1-(3-methylphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-1H-pyrrol-1-yl)benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1c(C)cc(c1C)/C=C/1\C(=O)N=C(N(C1=O)c1cccc(c1)C)S

STK853373
Synonyms: 6-amino-4-(3-methoxy-4-propoxyphenyl)-3-methyl-1-phenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCCOc1ccc(cc1OC)C1C(=C(N)Oc2c1c(C)nn2c1ccccc1)C#N

STK853374
Synonyms: (2Z)-7-{[bis(2-methoxyethyl)ammonio]methyl}-4-methyl-3-oxo-2-(pyridin-3-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: COCC[NH+](Cc1c([O-])cc(c2c1O/C(=C\c1cccnc1)/C2=O)C)CCOC

STK853376
Synonyms: (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-5-(4-methylphenyl)pyrrolidine-2,3-dione
Smiles: Cc1ccc(cc1)C1N(c2noc(c2)C)C(=O)C(=O)/C/1=C(\c1cc2c(o1)cccc2)/O

STK853381
Synonyms: 1-(3-methylphenyl)-N-[(2Z)-5-(methylsulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxo-1,4-dihydropyridazine-3-carboxamide
Smiles: CSc1n[nH]/c(=N/C(=O)c2nn(ccc2=O)c2cccc(c2)C)/s1

STK853382
Synonyms: 2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-5,6-dimethyl-3-(prop-2-en-1-yl)thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: C=CCn1c(SCC(=O)c2ccc(cc2)F)nc2c(c1=O)c(C)c(s2)C

STK853383
Synonyms: (4E)-4-[furan-2-yl(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: Cc1onc(c1)N1C(=O)C(=O)/C(=C(\c2ccco2)/O)/C1c1cccc(c1)[N+](=O)[O-]

STK853384
Synonyms: 9-(4-ethylphenyl)-7-hydroxy-1,3-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCc1ccc(cc1)N1CC(O)Cn2c1nc1c2c(=O)n(c(=O)n1C)C

STK853386
Synonyms: propan-2-yl4-(3-methoxyphenyl)-2-methyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Smiles: COc1cccc(c1)C1C(=C(C)N=c2n1c1ccccc1[nH]2)C(=O)OC(C)C

STK853387
Synonyms: 4-methyl-5-(pyrazin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cn1c(=S)[nH]nc1c1cnccn1

STK853391
Synonyms: 3-tert-butyl-7,9-dimethyl-1-[2-(morpholin-4-yl)ethyl]-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)C(C)(C)C

STK853392
Synonyms: 1-[(2Z)-5-[(4-cyclohexylphenoxy)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-(2-fluorophenyl)urea
Smiles: O=C(/N=c\1/[nH]nc(s1)COc1ccc(cc1)C1CCCCC1)Nc1ccccc1F

STK853393
Synonyms: 3-[(5Z)-5-(4-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-1-(4-fluorophenyl)pyrrolidine-2,5-dione
Smiles: Fc1ccc(cc1)N1C(=O)CC(C1=O)N1C(=S)S/C(=C\c2ccc(cc2)Cl)/C1=O

STK853394
Synonyms: ethyl2-{[(pyridin-3-ylmethyl)carbamoyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)NCc2cccnc2)sc2c1CCC2

STK853395
Synonyms: N-(5-fluoro-9-oxo-9H-xanthen-3-yl)-2-(2-methoxyphenoxy)acetamide
Smiles: COc1ccccc1OCC(=O)Nc1ccc2c(c1)oc1c(c2=O)cccc1F

STK853397
Synonyms: 2-(2-chlorophenoxy)-N-(5-fluoro-9-oxo-9H-xanthen-3-yl)acetamide
Smiles: O=C(Nc1ccc2c(c1)oc1c(c2=O)cccc1F)COc1ccccc1Cl

STK853398
Synonyms: methyl2-{[amino(oxo)acetyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)C(=O)N)sc2c1CCC2

STK853399
Synonyms: (4E)-5-(2,5-dimethoxyphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[furan-2-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1C1N(c2nc3c(s2)cc(cc3)CC)C(=O)C(=O)/C/1=C(\c1ccco1)/O)OC

STK853400
Synonyms: 8-(2-methoxyethyl)-1,6,7-trimethyl-3-(3-methylbutyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COCCn1c(C)c(n2c1nc1c2c(=O)n(c(=O)n1C)CCC(C)C)C

STK853402
Synonyms: 9-(4-chlorophenyl)-4-ethyl-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: CCc1cc(=O)oc2c1ccc1c2CN(CO1)c1ccc(cc1)Cl

STK853403
Synonyms: (4E)-5-(3-fluorophenyl)-4-[furan-2-yl(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: Fc1cccc(c1)C1/C(=C(/c2ccco2)\O)/C(=O)C(=O)N1c1noc(c1)C

STK853405
Synonyms: N-[2-(1H-imidazol-1-ylmethyl)-1-(2-methylpropyl)-1H-benzimidazol-5-yl]propanamide
Smiles: CCC(=O)Nc1ccc2c(c1)nc(n2CC(C)C)Cn1cncc1

STK853406
Synonyms: (4E)-5-(4-ethoxyphenyl)-4-[furan-2-yl(hydroxy)methylidene]-1-(pyrimidin-2-yl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2ccco2)\O)/C(=O)C(=O)N1c1ncccn1

STK853409
Synonyms: 3-bromo-N-[(2Z)-5-(phenoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: Brc1cccc(c1)C(=O)/N=c\1/[nH]nc(s1)COc1ccccc1

STK853411
Synonyms: 2-{[3-cyano-6-(3-methoxyphenyl)pyridin-2-yl]sulfanyl}-N-(2-methoxy-5-methylphenyl)acetamide
Smiles: COc1cccc(c1)c1ccc(c(n1)SCC(=O)Nc1cc(C)ccc1OC)C#N

STK853413
Synonyms: 2-(benzylsulfanyl)-6-iodo-3-phenylquinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)SCc1ccccc1)c1ccccc1

STK853414
Synonyms: (5E)-5-{[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene}-3-(3,4-dimethylphenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: OC1=NC(=O)N(C(=O)/C/1=C/c1ccc(o1)c1ccc(cc1Cl)[N+](=O)[O-])c1ccc(c(c1)C)C

STK853415
Synonyms: N-(5-chloro-9-oxo-9H-xanthen-3-yl)furan-2-carboxamide
Smiles: O=C(c1ccco1)Nc1ccc2c(c1)oc1c(c2=O)cccc1Cl

STK853416
Synonyms: (5Z)-6-hydroxy-5-(4-hydroxy-3,5-dimethoxybenzylidene)-3-[4-(propan-2-yl)phenyl]pyrimidine-2,4(3H,5H)-dione
Smiles: COc1cc(/C=C\2/C(=NC(=O)N(C2=O)c2ccc(cc2)C(C)C)O)cc(c1O)OC

STK853419
Synonyms: N-{1-methyl-2-[2-(2-oxopyridin-1(2H)-yl)ethyl]-1H-benzimidazol-5-yl}butanamide
Smiles: CCCC(=O)Nc1ccc2c(c1)nc(n2C)CCn1ccccc1=O

STK853421
Synonyms: (5Z)-5-{[1-(4-bromophenyl)-2,5-diphenyl-1H-pyrrol-3-yl]methylidene}-2,6-dihydroxypyrimidin-4(5H)-one
Smiles: OC1=NC(=O)/C(=C\c2cc(n(c2c2ccccc2)c2ccc(cc2)Br)c2ccccc2)/C(=N1)O

STK853422
Synonyms: 6-(3-bromophenyl)-7-(thiophen-2-yl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: Brc1cccc(c1)C1Oc2ccccc2C2=C1C(c1cccs1)n1c(N2)ncn1

STK853424
Synonyms: methyl2-{[amino(oxo)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)C(=O)N)sc2c1CCCC2

STK853426
Synonyms: N-[2-(1H-imidazol-1-ylmethyl)-1-(2-methylpropyl)-1H-benzimidazol-5-yl]butanamide
Smiles: CCCC(=O)Nc1ccc2c(c1)nc(n2CC(C)C)Cn1cncc1

STK853429
Synonyms: 4-(4-chlorobenzyl)-N-{(E)-[4-(diethylamino)phenyl]methylidene}piperazin-1-amine
Smiles: CCN(c1ccc(cc1)/C=N/N1CCN(CC1)Cc1ccc(cc1)Cl)CC

STK853431
Synonyms: N-[(2E)-3-(4-chlorobenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: Clc1ccc(cc1)CN1/C(=N\C(=O)C)/SC2C1CS(=O)(=O)C2

STK853433
Synonyms: N-(3,5-dimethoxyphenyl)-3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanamide
Smiles: COc1cc(NC(=O)CCc2c(=O)oc3c(c2C)ccc(c3)OC)cc(c1)OC

STK853435
Synonyms: 2-hydroxy-3-(2-hydroxyethyl)-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: OCCn1c(O)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK853437
Synonyms: (5Z)-6-hydroxy-5-{[5-(piperidin-1-yl)furan-2-yl]methylidene}-2-sulfanylpyrimidin-4(5H)-one
Smiles: SC1=NC(=O)/C(=C\c2ccc(o2)N2CCCCC2)/C(=N1)O

STK853439
Synonyms: 8-(4-fluorophenyl)-1-methyl-3-(prop-2-en-1-yl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: C=CCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccc(cc1)F

STK853442
Synonyms: 3-(3-hydroxypropyl)-1,7-dimethyl-8-(prop-2-en-1-yl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)CC=C)C

STK853443
Synonyms: methyl{3-[2-(4-chlorophenyl)ethyl]-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)CCc1ccc(cc1)Cl

STK853445
Synonyms: 6-methoxy-1-(4-nitrophenyl)-2-(1,3-thiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)C(N(C1=O)c1nccs1)c1ccc(cc1)[N+](=O)[O-]

STK853447
Synonyms: 3-{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}-2-hydroxyquinazolin-4(3H)-one
Smiles: O=C(N1CCN(CC1)c1cccc(c1C)C)CCn1c(O)nc2c(c1=O)cccc2

STK853450
Synonyms: (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: Cc1onc(c1)N1C(c2cccc(c2)[N+](=O)[O-])/C(=C(/c2cc3c(o2)cccc3)\O)/C(=O)C1=O

STK853451
Synonyms: 3-(2-fluorobenzyl)-9-(2-methoxyphenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: COc1ccccc1N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1F

STK853452
Synonyms: (5Z)-1-(4-chlorophenyl)-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Clc1ccc(cc1)N1C(=NC(=O)/C(=C/c2ccc(o2)c2ccccc2[N+](=O)[O-])/C1=O)S

STK853453
Synonyms: 3-(4-methoxyphenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccccc2)nc2c(c1=O)cccc2

STK853454
Synonyms: 3-benzyl-1,7-dimethyl-8-(2-methylpropyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(Cn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1)C

STK853456
Synonyms: 1-(4-chlorophenyl)-3-[(2Z)-5-[(2-fluorophenoxy)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: Clc1ccc(cc1)NC(=O)/N=c\1/[nH]nc(s1)COc1ccccc1F

STK853457
Synonyms: 3-butyl-1,7-dimethyl[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: CCCCn1c(=O)n(C)c2c(c1=O)n1cc(oc1n2)C

STK853459
Synonyms: 4-[2-(2-oxopyrrolidin-1-yl)ethoxy]benzaldehyde
Smiles: O=Cc1ccc(cc1)OCCN1CCCC1=O

STK853460
Synonyms: 3-(2-hydroxyethyl)-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: OCCn1cnc2c(c1=O)sc1c2cc2c(n1)CC(OC2)(C)C

STK853464
Synonyms: 1-benzyl-3,7,9-trimethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: CC1=NN(Cc2ccccc2)c2n(C1)c1c(n2)n(C)c(=O)n(c1=O)C

STK853465
Synonyms: (2Z)-4-methyl-3-oxo-2-(pyridin-3-ylmethylidene)-7-(pyrrolidinium-1-ylmethyl)-2,3-dihydro-1-benzofuran-6-olate
Smiles: Cc1cc([O-])c(c2c1C(=O)/C(=C/c1cccnc1)/O2)C[NH+]1CCCC1

STK853466
Synonyms: 3-fluoro-N-(9-oxo-9H-xanthen-3-yl)benzamide
Smiles: Fc1cccc(c1)C(=O)Nc1ccc2c(c1)oc1c(c2=O)cccc1

STK853467
Synonyms: N-(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-N'-(pyridin-3-ylmethyl)ethanediamide
Smiles: O=C(C(=O)NCc1cccnc1)Nc1sc2c(c1C(=O)N)CCC2

STK853470
Synonyms: 2-(2-fluorophenoxy)-N-(9-oxo-9H-xanthen-3-yl)acetamide
Smiles: O=C(Nc1ccc2c(c1)oc1c(c2=O)cccc1)COc1ccccc1F

STK853471
Synonyms: N-[1-cyclopentyl-5-oxo-2-phenyl-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl]-2-methoxybenzamide
Smiles: COc1ccccc1C(=O)NC1(N=C(N(C1=O)C1CCCC1)c1ccccc1)C(F)(F)F

STK853472
Synonyms: (4E)-4-[hydroxy(3-methoxyphenyl)methylidene]-5-(4-methylphenyl)-1-(pyridin-2-yl)pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)/C(=C\1/C(c2ccc(cc2)C)N(C(=O)C1=O)c1ccccn1)/O

STK853473
Synonyms: N-{2-[(4-chlorophenyl)carbonyl]-1-benzofuran-3-yl}-4-ethyl-1,2,3-thiadiazole-5-carboxamide
Smiles: CCc1nnsc1C(=O)Nc1c(oc2c1cccc2)C(=O)c1ccc(cc1)Cl

STK853475
Synonyms: N-(4-methoxyphenyl)-2-(4-methyl-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-1-yl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CN1C(=O)CN(C(=O)c2c1cccc2)C

STK853480
Synonyms: 4-[2-(5-chloro-2-methoxyphenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: COc1ccc(cc1C(=O)CN1C(=O)COc2c(C1=O)cccc2)Cl

STK853481
Synonyms: 1-cyclohexyl-3-{2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}urea
Smiles: O=C(Nc1ccc2c(c1)nc(n2C)CCn1nc(cc1C)C)NC1CCCCC1

STK853485
Synonyms: 3-(3-chlorobenzyl)-1,6,7-trimethyl-8-[2-(morpholin-4-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Clc1cccc(c1)Cn1c(=O)n(C)c2c(c1=O)n1c(n2)n(c(c1C)C)CCN1CCOCC1

STK853487
Synonyms: 4-[(2-methoxyethyl)sulfanyl]-7,7-dimethyl-2-(methylsulfanyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine
Smiles: COCCSc1nc(SC)nc2c1sc1c2COC(C1)(C)C

STK853489
Synonyms: 8-[3-(1H-imidazol-1-yl)propyl]-1,7-dimethyl-3-[(2E)-3-phenylprop-2-en-1-yl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cn1c(=O)n(C/C=C/c2ccccc2)c(=O)c2c1nc1n2cc(n1CCCn1cncc1)C

STK853490
Synonyms: (2Z)-4-methyl-3-oxo-2-(pyridin-4-ylmethylidene)-7-(pyrrolidinium-1-ylmethyl)-2,3-dihydro-1-benzofuran-6-olate
Smiles: Cc1cc([O-])c(c2c1C(=O)/C(=C/c1ccncc1)/O2)C[NH+]1CCCC1

STK853493
Synonyms: (4E)-5-(4-fluorophenyl)-4-[furan-2-yl(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: Fc1ccc(cc1)C1/C(=C(/c2ccco2)\O)/C(=O)C(=O)N1c1noc(c1)C

STK853494
Synonyms: 5-{4-[(2-chlorophenyl)carbonyl]piperazin-1-yl}-2-(furan-2-yl)-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1ccccc1Cl)c1ccco1

STK853495
Synonyms: 10-ethyl-10-methyl-5-(methylsulfanyl)-3-[(2-phenylethyl)sulfanyl]-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CCC1(C)OCc2c(C1)c1c(s2)nc(n2c1nnc2SCCc1ccccc1)SC

STK853496
Synonyms: (5Z)-1-(3-ethoxyphenyl)-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCOc1cccc(c1)N1C(=NC(=O)/C(=C/c2ccc(o2)c2ccccc2[N+](=O)[O-])/C1=O)S

STK853498
Synonyms: 4-(4-chlorobenzyl)-N-[(E)-(2,6-dichlorophenyl)methylidene]piperazin-1-amine
Smiles: Clc1ccc(cc1)CN1CCN(CC1)/N=C/c1c(Cl)cccc1Cl

STK853502
Synonyms: 4-chloro-N-(5-fluoro-9-oxo-9H-xanthen-3-yl)benzamide
Smiles: Clc1ccc(cc1)C(=O)Nc1ccc2c(c1)oc1c(c2=O)cccc1F

STK853508
Synonyms: 2-(2-chlorophenoxy)-N-(9-oxo-9H-xanthen-3-yl)acetamide
Smiles: O=C(Nc1ccc2c(c1)oc1c(c2=O)cccc1)COc1ccccc1Cl

STK853509
Synonyms: (4E)-4-[hydroxy(phenyl)methylidene]-1-[3-(1H-imidazol-1-yl)propyl]-5-(pyridin-2-yl)pyrrolidine-2,3-dione
Smiles: O=C1C(=O)/C(=C(\c2ccccc2)/O)/C(N1CCCn1cncc1)c1ccccn1

STK853511
Synonyms: N-(5-fluoro-9-oxo-9H-xanthen-3-yl)-2-(2-fluorophenoxy)acetamide
Smiles: O=C(Nc1ccc2c(c1)oc1c(c2=O)cccc1F)COc1ccccc1F

STK853513
Synonyms: N-(4-methyl-5-{[2-(phenylsulfonyl)hydrazinyl]carbonyl}-1,3-thiazol-2-yl)benzenesulfonamide
Smiles: O=C(c1sc(nc1C)NS(=O)(=O)c1ccccc1)NNS(=O)(=O)c1ccccc1

STK853514
Synonyms: (5E)-2,6-dihydroxy-5-[(2-methyl-1,5-diphenyl-1H-pyrrol-3-yl)methylidene]pyrimidin-4(5H)-one
Smiles: OC1=NC(=O)/C(=C/c2cc(n(c2C)c2ccccc2)c2ccccc2)/C(=N1)O

STK853517
Synonyms: (2Z)-4-methyl-3-oxo-7-(piperidinium-1-ylmethyl)-2-(pyridin-4-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: Cc1cc([O-])c(c2c1C(=O)/C(=C/c1ccncc1)/O2)C[NH+]1CCCCC1

STK853520
Synonyms: (5Z)-5-{[5-(2-bromo-4-methylphenyl)furan-2-yl]methylidene}-6-hydroxy-2-sulfanylpyrimidin-4(5H)-one
Smiles: SC1=NC(=O)/C(=C\c2ccc(o2)c2ccc(cc2Br)C)/C(=N1)O

STK853524
Synonyms: (2E)-3-(3,4-dimethoxyphenyl)-N-(9-oxo-9H-xanthen-3-yl)prop-2-enamide
Smiles: COc1cc(/C=C/C(=O)Nc2ccc3c(c2)oc2c(c3=O)cccc2)ccc1OC

STK853525
Synonyms: 1-(2,4-dimethylphenyl)-5-[(naphthalen-1-yloxy)methyl]-1H-tetrazole
Smiles: Cc1ccc(c(c1)C)n1nnnc1COc1cccc2c1cccc2

STK853526
Synonyms: (4E)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-[4-(propan-2-yl)phenyl]pyrrolidine-2,3-dione
Smiles: CC(Oc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)C(C)C)N(C(=O)C1=O)c1nnc(s1)C)/O)C

STK853529
Synonyms: (2Z)-7-[(4-ethylpiperazin-1-ium-1-yl)methyl]-4-methyl-3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCN1CC[NH+](CC1)Cc1c([O-])cc(c2c1O/C(=C\c1cc(OC)c(c(c1)OC)OC)/C2=O)C

STK853530
Synonyms: (5E)-5-(4-hydroxy-3-methoxybenzylidene)-2-[(4-hydroxyphenyl)amino]-1,3-thiazol-4(5H)-one
Smiles: COc1cc(ccc1O)/C=C\1/SC(=NC1=O)Nc1ccc(cc1)O

STK853531
Synonyms: N-{2-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]ethyl}benzenesulfonamide
Smiles: Cn1c(SCCNS(=O)(=O)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK853533
Synonyms: (2E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-[(4-methoxyphenyl)sulfonyl]prop-2-enenitrile
Smiles: COc1ccc(cc1)S(=O)(=O)/C(=C/Nc1ccc2c(c1)OCCO2)/C#N

STK853536
Synonyms: 6-methoxy-2-[3-(morpholin-4-yl)propyl]-1-(pyridin-4-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)C(N(C1=O)CCCN1CCOCC1)c1ccncc1

STK853537
Synonyms: (4E)-5-(4-chlorophenyl)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)Cl)c1nnc(s1)C)/O