COMPOUNDS FOR BIOLOGICAL SCREENING
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Total number of items: 1633432
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STK054786
Synonyms: (6Z)-6-{3-bromo-5-methoxy-4-[2-(4-methoxyphenoxy)ethoxy]benzylidene}-5-imino-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1ccc(cc1)OCCOc1c(Br)cc(cc1OC)/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1

STK054797
Synonyms: 3,6,6-trimethyl-2-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC1=NN(C(=O)C1)c1nc2sc3c(c2c(=O)n1C)CC(OC3)(C)C

STK054808
Synonyms: 1-{4-[(3-methylpiperidin-1-yl)carbonyl]piperidin-1-yl}-2-(2-oxopyridin-1(2H)-yl)-3-phenylpropane-1,3-dione
Smiles: CC1CCCN(C1)C(=O)C1CCN(CC1)C(=O)C(n1ccccc1=O)C(=O)c1ccccc1

STK054809
Synonyms: N'-[(2E)-3-phenylprop-2-enoyl]pyridine-2-carbohydrazide
Smiles: O=C(NNC(=O)c1ccccn1)/C=C/c1ccccc1

STK054821
Synonyms: 2-{(2E)-2-[4-(dimethylamino)benzylidene]hydrazinyl}-3-methyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CN(c1ccc(cc1)/C=N/Nc1nc2sc3c(c2c(=O)n1C)CCC3)C

STK054872
Synonyms: 2-(2,5-dihydroxyphenyl)quinoline-4-carboxylicacid
Smiles: Oc1ccc(c(c1)c1nc2ccccc2c(c1)C(=O)O)O

STK054874
Synonyms: 2-methyl-5-[2-(6-methylpyridin-3-yl)ethyl]-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole
Smiles: CN1CCc2c(C1)c1ccccc1n2CCc1ccc(nc1)C

STK054879
Synonyms: [5-(benzyloxy)-1H-indol-2-yl](pyrrolidin-1-yl)methanone
Smiles: O=C(c1[nH]c2c(c1)cc(cc2)OCc1ccccc1)N1CCCC1

STK054887
Synonyms: 2-phenyl[1,3]oxazolo[4,5-c]quinolin-4(5H)-one
Smiles: O=c1[nH]c2ccccc2c2c1nc(o2)c1ccccc1

STK054893
Synonyms: 5'-bromo-4-methylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one
Smiles: CC1CCOC2(O1)C(=O)Nc1c2cc(Br)cc1

STK054917
Synonyms: N'-[(3E)-5-chloro-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2-(2-methylphenoxy)acetohydrazide
Smiles: O=C(COc1ccccc1C)N/N=C\1/C(=O)Nc2c1cc(Cl)cc2

STK054919
Synonyms: 1-[5-hydroxy-5-(pentafluoroethyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-2-phenylethanone
Smiles: O=C(N1N=C(CC1(O)C(C(F)(F)F)(F)F)c1ccccc1)Cc1ccccc1

STK054939
Synonyms: (4Z)-5-methyl-2-(4-phenyl-1,3-thiazol-2-yl)-4-[2-(1,3-thiazol-2-yl)hydrazinylidene]-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC1=NN(C(=O)/C/1=N\Nc1nccs1)c1scc(n1)c1ccccc1

STK054949
Synonyms: 3-hydroxy-2-(4-phenylbutan-2-yl)-2,3,4,5,6,7-hexahydro-1H-isoindol-1-one
Smiles: CC(N1C(O)C2=C(C1=O)CCCC2)CCc1ccccc1

STK054959
Synonyms: 4-chloro-2-[(2,2-dimethylpropanoyl)amino]benzoicacid
Smiles: O=C(C(C)(C)C)Nc1cc(Cl)ccc1C(=O)O

STK054962
Synonyms: (2E)-2-[2-(3-methylphenyl)hydrazinylidene]-3-oxo-3-phenyl-N-(4-phenyl-1,3-thiazol-2-yl)propanamide
Smiles: Cc1cccc(c1)N/N=C(\C(=O)c1ccccc1)/C(=O)Nc1scc(n1)c1ccccc1

STK054967
Synonyms: ethyl4-(2,3-dihydro-1,4-benzodioxin-2-yl)-2-({[5-(4-methylphenyl)furan-2-yl]carbonyl}amino)thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1C1COc2c(O1)cccc2)NC(=O)c1ccc(o1)c1ccc(cc1)C

STK054978
Synonyms: (2Z)-6,8-dichloro-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-[(4-methoxyphenyl)imino]-2H-chromene-3-carboxamide
Smiles: COc1ccc(cc1)/N=c/1\oc2c(cc1C(=O)Nc1scc(n1)c1ccc(cc1)Cl)cc(cc2Cl)Cl

STK054984
Synonyms: 5,5-diethyl-2-{[3-(trifluoromethyl)phenyl]imino}dihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCC1(CC)C(=O)NC(=Nc2cccc(c2)C(F)(F)F)NC1=O

STK055019
Synonyms: 2-(4-ethylphenyl)-5-(3-nitrophenyl)-1,3,4-oxadiazole
Smiles: CCc1ccc(cc1)c1nnc(o1)c1cccc(c1)[N+](=O)[O-]

STK055025
Synonyms: (2Z)-2-[(4-methylphenyl)imino]-N-(pyridin-3-yl)-2H-chromene-3-carboxamide
Smiles: Cc1ccc(cc1)/N=c/1\oc2ccccc2cc1C(=O)Nc1cccnc1

STK055039
Synonyms: 5-bromo-N-(3,4-dimethylphenyl)furan-2-carboxamide
Smiles: Brc1ccc(o1)C(=O)Nc1ccc(c(c1)C)C

STK055046
Synonyms: furan-2-yl[(2R,4S)-4-hydroxy-2,6-dimethyl-3,4-dihydroquinolin-1(2H)-yl]methanone
Smiles: Cc1ccc2c(c1)[C@@H](O)C[C@H](N2C(=O)c1ccco1)C

STK055052
Synonyms: 2-({[(3-butoxyphenyl)carbonyl]carbamothioyl}amino)-3,5-dichlorobenzoicacid
Smiles: CCCCOc1cccc(c1)C(=O)NC(=S)Nc1c(Cl)cc(cc1C(=O)O)Cl

STK055090
Synonyms: 2-amino-5-oxo-4-[5-(2,4,6-trichlorophenyl)thiophen-2-yl]-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Smiles: N#CC1=C(N)OC2=C(C1c1ccc(s1)c1c(Cl)cc(cc1Cl)Cl)C(=O)CCC2

STK055103
Synonyms: 6-chloro-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-oxo-2H-chromene-3-carboxamide
Smiles: Cc1ccc(cc1)c1csc(n1)NC(=O)c1cc2cc(Cl)ccc2oc1=O

STK055105
Synonyms: tert-butyl(2E)-2-(4-{[(2-chlorophenyl)carbonyl]oxy}benzylidene)hydrazinecarboxylate
Smiles: O=C(OC(C)(C)C)N/N=C/c1ccc(cc1)OC(=O)c1ccccc1Cl

STK055129
Synonyms: (6E)-2-benzyl-5-imino-6-{3-methoxy-4-[2-(3-methylphenoxy)ethoxy]benzylidene}-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1cc(ccc1OCCOc1cccc(c1)C)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)Cc1ccccc1

STK055167
Synonyms: (3E)-5-(4-methylphenyl)-3-[4-(propan-2-yl)benzylidene]furan-2(3H)-one
Smiles: Cc1ccc(cc1)C1=C/C(=C\c2ccc(cc2)C(C)C)/C(=O)O1

STK055168
Synonyms: trimethyl1,3,5-triazinane-1,3,5-tricarboxylate
Smiles: COC(=O)N1CN(CN(C1)C(=O)OC)C(=O)OC

STK055182
Synonyms:
Smiles: O=C1CC2[C@@]3(C[C@@H]1C(=C)[C@H]3O)C1C3[C@@]42[C@@H](O)CC[C@](C4C1)(CN3)C

STK055186
Synonyms: methyl{4-bromo-2-[(cyclohexylamino)methyl]phenoxy}acetate
Smiles: COC(=O)COc1ccc(cc1CNC1CCCCC1)Br

STK055192
Synonyms: 3-{4-[(5-methylhexyl)oxy]benzyl}pyrrolidine-2,5-dione
Smiles: CC(CCCCOc1ccc(cc1)CC1CC(=O)NC1=O)C

STK055196
Synonyms: 5-chloro-N-(2,6-dichloro-4-nitrophenyl)-2-hydroxybenzamide
Smiles: Clc1ccc(c(c1)C(=O)Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-])O

STK055215
Synonyms: 2-[(1-butyl-1H-benzimidazol-2-yl)sulfanyl]-1-(3-methoxyphenyl)ethanone
Smiles: CCCCn1c(SCC(=O)c2cccc(c2)OC)nc2c1cccc2

STK055224
Synonyms: benzene-1,3-diylbis(4-ethylbenzoate)
Smiles: CCc1ccc(cc1)C(=O)Oc1cccc(c1)OC(=O)c1ccc(cc1)CC

STK055235
Synonyms: 2-(4-methylphenyl)-5-(prop-2-yn-1-ylsulfonyl)-1,3,4-oxadiazole
Smiles: C#CCS(=O)(=O)c1nnc(o1)c1ccc(cc1)C

STK055256
Synonyms: methyl1-amino-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylate
Smiles: COC(=O)c1sc2c(c1N)c1CCCCc1c(n2)CC

STK055257
Synonyms: N-(3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)cyclohexanecarboxamide
Smiles: N#Cc1c(NC(=O)C2CCCCC2)sc2c1CC(C)CC2

STK055266
Synonyms: N-{[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-2-nitrobenzamide
Smiles: S=C(NC(=O)c1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)nc(o2)c1ccc(c(c1)Br)O

STK055295
Synonyms: (5Z)-3-methyl-5-{2-[2-(2-phenoxyethoxy)ethoxy]benzylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: CN1C(=S)S/C(=C\c2ccccc2OCCOCCOc2ccccc2)/C1=O

STK055298
Synonyms: 6-[(E)-2-(2-methoxyphenyl)ethenyl]-1,3-dimethyl-5-nitropyrimidine-2,4(1H,3H)-dione
Smiles: COc1ccccc1/C=C/c1n(C)c(=O)n(c(=O)c1[N+](=O)[O-])C

STK055306
Synonyms: N-(3-hydroxypropyl)piperidine-4-carboxamide
Smiles: OCCCNC(=O)C1CCNCC1

STK055310
Synonyms: 2-(1-acetyl-3-methyl-1H-1,2,4-triazol-5-yl)phenylacetate
Smiles: CC(=O)Oc1ccccc1c1nc(nn1C(=O)C)C

STK055320
Synonyms: 5-(2-bromophenyl)-3-(2,6-difluorophenyl)-1,2,4-oxadiazole
Smiles: Brc1ccccc1c1onc(n1)c1c(F)cccc1F

STK055323
Synonyms: 2-methyl-3-{5-[(E)-(1-{2-[(4-methylphenyl)amino]-2-oxoethyl}-2,5-dioxoimidazolidin-4-ylidene)methyl]furan-2-yl}benzoicacid
Smiles: O=C(CN1C(=O)N/C(=C/c2ccc(o2)c2cccc(c2C)C(=O)O)/C1=O)Nc1ccc(cc1)C

STK055328
Synonyms: 7,7-dimethyl-1-(2-phenylethyl)-1,2,3,6,7,9-hexahydro-5H-imidazo[1,2-a]pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-5-one
Smiles: O=c1c2c(sc3c2CC(C)(C)OC3)nc2n1CCN2CCc1ccccc1

STK055346
Synonyms: 5-ethyl-4-(4-fluorophenyl)-1,3-thiazol-2-amine
Smiles: CCc1sc(nc1c1ccc(cc1)F)N

STK055414
Synonyms: naphthalen-2-yl5-(4-chlorophenyl)furan-2-carboxylate
Smiles: Clc1ccc(cc1)c1ccc(o1)C(=O)Oc1ccc2c(c1)cccc2

STK055458
Synonyms: 6-hydroxy-2-{[2-oxo-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]sulfanyl}-3-(prop-2-en-1-yl)pyrimidin-4(3H)-one
Smiles: C=CCn1c(=O)cc(nc1SCC(=O)C12CC3CC(C2)CC(C1)C3)O

STK055466
Synonyms: 3-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)benzonitrile
Smiles: N#Cc1cccc(c1)N1C(=O)C=CC1=O

STK055469
Synonyms: 7-tert-butyl-5,6-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidine-ethane(1:1)
Smiles: Cc1nc2cc(nn2c(c1C)C(C)(C)C)c1ccccc1.CC

STK055471
Synonyms: ethyl[(4-amino-6-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
Smiles: CCOC(=O)CSc1nc(N)c2c(n1)sc1c2CC(CC1)C

STK055493
Synonyms: (2Z)-3-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-2-(1,3-thiazol-2-ylimino)-2H-chromen-7-ol
Smiles: Oc1ccc2c(c1)o/c(=N\c1nccs1)/c(c2)c1scc(n1)c1ccc(c(c1)Cl)Cl

STK055502
Synonyms: 4-(2,5-dimethyl-3-{(E)-[2-(5-nitropyridin-2-yl)hydrazinylidene]methyl}-1H-pyrrol-1-yl)phenol
Smiles: Oc1ccc(cc1)n1c(C)cc(c1C)/C=N/Nc1ccc(cn1)[N+](=O)[O-]

STK055527
Synonyms: 2,5-diiodo-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
Smiles: Ic1ccc(c(c1)C(=O)Nc1scc(n1)c1ccccc1)I

STK055530
Synonyms: 2-{[1-(4-methylbenzyl)-1H-benzimidazol-2-yl]sulfanyl}-N'-[(1E)-1-phenylethylidene]acetohydrazide
Smiles: O=C(CSc1nc2c(n1Cc1ccc(cc1)C)cccc2)N/N=C(/c1ccccc1)\C

STK055534
Synonyms: N-(4,4,6-trimethyl-2-thioxo-3,4-dihydropyrimidin-1(2H)-yl)furan-2-carboxamide
Smiles: S=C1NC(C)(C)C=C(N1NC(=O)c1ccco1)C

STK055539
Synonyms: [5-hydroxy-3-phenyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl](2-methylfuran-3-yl)methanone
Smiles: O=C(N1N=C(CC1(O)C(F)(F)F)c1ccccc1)c1ccoc1C

STK055558
Synonyms: 2-chloro-4-{[(3-chloro-4-ethoxyphenyl)carbonyl]amino}benzoicacid
Smiles: CCOc1ccc(cc1Cl)C(=O)Nc1ccc(c(c1)Cl)C(=O)O

STK055619
Synonyms: 5-{4-[(1H-benzimidazol-2-ylmethyl)amino]phthalazin-1-yl}-N-(2-hydroxyethyl)-2-methylbenzenesulfonamide
Smiles: OCCNS(=O)(=O)c1cc(ccc1C)c1nnc(c2c1cccc2)NCc1nc2c([nH]1)cccc2

STK055643
Synonyms: 4-(methoxycarbonyl)phenyl3,4-dimethoxybenzoate
Smiles: COC(=O)c1ccc(cc1)OC(=O)c1ccc(c(c1)OC)OC

STK055684
Synonyms: ornithyl-N-{4-bromo-2-[(2-chlorophenyl)carbonyl]phenyl}glycinamide
Smiles: NCCCC(C(=O)NCC(=O)Nc1ccc(cc1C(=O)c1ccccc1Cl)Br)N

STK055699
Synonyms: [4-(dihydroxymethyl)phenyl]boronicacid
Smiles: OB(c1ccc(cc1)C(O)O)O

STK055706
Synonyms: (6Z)-6-[3-bromo-5-methoxy-4-(2-phenoxyethoxy)benzylidene]-5-imino-2-propyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCCc1sc2=NC(=O)/C(=C\c3cc(Br)c(c(c3)OC)OCCOc3ccccc3)/C(=N)n2n1

STK055735
Synonyms: N-(6-hydroxy-6-methylheptan-2-yl)-1-(4-methoxybenzyl)piperidine-4-carboxamide
Smiles: COc1ccc(cc1)CN1CCC(CC1)C(=O)NC(CCCC(O)(C)C)C

STK055739
Synonyms: 2-{[2-(diethylamino)ethyl]carbamoyl}cyclohexanecarboxylicacid
Smiles: CCN(CCNC(=O)C1CCCCC1C(=O)O)CC

STK055743
Synonyms: propan-2-yl3-amino-6-(pyridin-3-yl)thieno[2,3-b]pyridine-2-carboxylate
Smiles: CC(OC(=O)c1sc2c(c1N)ccc(n2)c1cccnc1)C

STK055759
Synonyms: N-{[4-(4-chlorophenyl)-1,3-thiazol-2-yl]carbamothioyl}butanamide
Smiles: CCCC(=O)NC(=S)Nc1scc(n1)c1ccc(cc1)Cl

STK055798
Synonyms: 3-benzyl-5-(2-bromophenyl)-1,2,4-oxadiazole
Smiles: Brc1ccccc1c1onc(n1)Cc1ccccc1

STK055799
Synonyms: [3-(acetyloxy)-3-(4-tert-butylphenyl)propyl](chloro)mercury
Smiles: Cl[Hg]CCC(c1ccc(cc1)C(C)(C)C)OC(=O)C

STK055803
Synonyms: N-[ethyl(phenyl)carbamothioyl]propanamide
Smiles: CCN(c1ccccc1)C(=S)NC(=O)CC

STK055819
Synonyms: N-{(2Z)-3-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-6-methoxy-2H-chromen-2-ylidene}-1,3-thiazol-2-amine
Smiles: CCc1ccc(cc1)c1csc(n1)c1cc2cc(OC)ccc2o/c/1=N\c1nccs1

STK055833
Synonyms: 5-methyl-3-[(4-methylquinazolin-2-yl)amino]-1H-2,4-benzodiazepin-1-one
Smiles: Cc1nc(Nc2nc(=O)c3c(c(n2)C)cccc3)nc2c1cccc2

STK055849
Synonyms: diethyl2-[2,2,7-trimethyl-1-(phenylacetyl)-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene]-1,3-dithiole-4,5-dicarboxylate
Smiles: CCOC(=O)C1=C(S/C(=C\2/c3ccc(cc3N(C(C2=S)(C)C)C(=O)Cc2ccccc2)C)/S1)C(=O)OCC

STK055855
Synonyms: N-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}pyridine-3-carboxamide
Smiles: Fc1ccc(cc1)N1CCN(CC1)CNC(=O)c1cccnc1

STK055857
Synonyms: (aminomethyl)(piperidin-1-ylmethyl)phosphinicacid
Smiles: NCP(=O)(CN1CCCCC1)O

STK055879
Synonyms: 2-bromo-N'-(phenoxyacetyl)benzohydrazide
Smiles: O=C(NNC(=O)c1ccccc1Br)COc1ccccc1

STK055882
Synonyms: N-[3-(tert-butylcarbamoyl)phenyl]-3-methoxybenzamide
Smiles: COc1cccc(c1)C(=O)Nc1cccc(c1)C(=O)NC(C)(C)C

STK055885
Synonyms: 7-(2-methoxybenzyl)-1,3-dimethyl-8-(4-methylpiperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccccc1Cn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCC(CC1)C

STK055887
Synonyms: N-tert-butyl-1-(3-methylbutyl)piperidine-4-carboxamide
Smiles: CC(CCN1CCC(CC1)C(=O)NC(C)(C)C)C

STK055897
Synonyms: (2Z)-N-ethyl-4-oxo-2-(phenylimino)-3-(3-phenylpropyl)-1,3-thiazinane-6-carboxamide
Smiles: CCNC(=O)C1CC(=O)N(/C(=N/c2ccccc2)/S1)CCCc1ccccc1

STK055916
Synonyms: 2-(4-bromo-3-nitro-1H-pyrazol-1-yl)-N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N-methylacetamide
Smiles: O=C(N(Cc1cn(nc1C)C)C)Cn1cc(c(n1)[N+](=O)[O-])Br

STK055933
Synonyms: 1-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-phenylthiourea
Smiles: N#Cc1c(NC(=S)Nc2ccccc2)sc2c1CCC2

STK055953
Synonyms: 3-amino-N-(4-fluorophenyl)-6-(pyridin-3-yl)thieno[2,3-b]pyridine-2-carboximidamide
Smiles: Fc1ccc(cc1)NC(=N)c1sc2c(c1N)ccc(n2)c1cccnc1

STK055986
Synonyms: 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-7-methyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CN1CCc2c(C1)sc1c2c(=O)[nH]c(n1)SCC(=O)c1ccc(cc1)Cl

STK055997
Synonyms: {4-[(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)amino]phenoxy}aceticacid
Smiles: O=C(C12CC3CC(C2)CC(C1)C3)Nc1ccc(cc1)OCC(=O)O

STK056000
Synonyms: ethyl2-({[(4-methoxy-3-nitrophenyl)carbonyl]carbamothioyl}amino)-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(nc1C)NC(=S)NC(=O)c1ccc(c(c1)[N+](=O)[O-])OC

STK056022
Synonyms: 2-(4-chlorophenyl)-N-{[4-(morpholin-4-yl)phenyl]carbamothioyl}acetamide
Smiles: O=C(Cc1ccc(cc1)Cl)NC(=S)Nc1ccc(cc1)N1CCOCC1

STK056033
Synonyms: N-{1,3-benzodioxol-5-yl[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]methyl}ethanamine
Smiles: CCNC(c1nnnn1c1c(C)cccc1C)c1ccc2c(c1)OCO2

STK056045
Synonyms: 5-bromo-N-[(2-hydroxyethyl)carbamothioyl]pyridine-3-carboxamide
Smiles: OCCNC(=S)NC(=O)c1cncc(c1)Br

STK056052
Synonyms: 5-[(1,3-benzoxazol-2-ylsulfanyl)methyl]-N-ethyl-1,3,4-thiadiazol-2-amine
Smiles: CCNc1nnc(s1)CSc1nc2c(o1)cccc2

STK056077
Synonyms: 2-amino-6-{[2-oxo-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]sulfanyl}-4-(3,4,5-trimethoxyphenyl)pyridine-3,5-dicarbonitrile
Smiles: N#Cc1c(SCC(=O)C23CC4CC(C3)CC(C2)C4)nc(c(c1c1cc(OC)c(c(c1)OC)OC)C#N)N

STK056084
Synonyms: N-(1-phenylethyl)morpholine-4-carboxamide
Smiles: CC(c1ccccc1)NC(=O)N1CCOCC1

STK056145
Synonyms: 2-[(4,6-dioxo-1,4,5,6-tetrahydropyrimidin-2-yl)sulfanyl]-N-hexadecylacetamide
Smiles: CCCCCCCCCCCCCCCCNC(=O)CSC1=NC(=O)CC(=O)N1

STK056156
Synonyms: sodium{2,2-bis[bis(propan-2-yloxy)phosphoryl]ethyl}phosphinate
Smiles: [Na]OP(=O)CC(P(=O)(OC(C)C)OC(C)C)P(=O)(OC(C)C)OC(C)C

STK056162
Synonyms: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-iodobenzamide
Smiles: Brc1ccc(cc1)c1nnc(s1)NC(=O)c1ccccc1I

STK056201
Synonyms: N-(2,5-dimethoxyphenyl)-5-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)pentanamide
Smiles: COc1ccc(cc1NC(=O)CCCCN1C(=O)c2c(C1=O)cccc2)OC

STK056208
Synonyms: 1H-indol-2-ylacetate
Smiles: CC(=O)Oc1cc2c([nH]1)cccc2

STK056214
Synonyms: [2-(4-methoxyphenyl)-4-(4-phenoxyphenyl)-1,3-thiazol-5-yl]aceticacid
Smiles: COc1ccc(cc1)c1sc(c(n1)c1ccc(cc1)Oc1ccccc1)CC(=O)O

STK056218
Synonyms: {(2Z)-2-[(2-chlorophenyl)imino]-5-methyl-1,3-thiazolidin-3-yl}(4-fluorophenyl)methanone
Smiles: CC1S/C(=N\c2ccccc2Cl)/N(C1)C(=O)c1ccc(cc1)F

STK056223
Synonyms: N-(butylcarbamoyl)-4-{[(E)-(2-ethoxyphenyl)methylidene]amino}benzenesulfonamide
Smiles: CCCCNC(=O)NS(=O)(=O)c1ccc(cc1)/N=C/c1ccccc1OCC

STK056226
Synonyms: 1-methoxy-2-phenyl-1,5,6,7-tetrahydro-4H-benzimidazol-4-one
Smiles: COn1c(nc2c1CCCC2=O)c1ccccc1

STK056250
Synonyms: (2E,5Z)-2,5-bis(1H-indol-3-ylmethylidene)cyclohexanone
Smiles: O=C1C/C(=C\c2c[nH]c3c2cccc3)/CC/C/1=C\c1c[nH]c2c1cccc2

STK056276
Synonyms: 6-amino-2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]pyrimidin-4(3H)-one
Smiles: Nc1cc(=O)[nH]c(n1)SCc1nc2c([nH]1)cccc2

STK056278
Synonyms: propan-2-yl3-amino-6-(thiophen-2-yl)-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxylate
Smiles: CC(OC(=O)c1sc2c(c1N)c(cc(n2)c1cccs1)C(F)(F)F)C

STK056280
Synonyms: methyl(3-{(Z)-[2,4-dioxo-3-(prop-2-yn-1-yl)-1,3-thiazolidin-5-ylidene]methyl}-1H-indol-1-yl)acetate
Smiles: C#CCN1C(=O)S/C(=C\c2cn(c3c2cccc3)CC(=O)OC)/C1=O

STK056287
Synonyms: 1-(3-methyl-1H-indol-2-yl)-2-phenylethanone
Smiles: O=C(c1[nH]c2c(c1C)cccc2)Cc1ccccc1

STK056341
Synonyms: (4-{(1E)-2-cyano-3-[(4-methyl-2-nitrophenyl)amino]-3-oxoprop-1-en-1-yl}phenoxy)aceticacid
Smiles: N#C/C(=C\c1ccc(cc1)OCC(=O)O)/C(=O)Nc1ccc(cc1[N+](=O)[O-])C

STK056346
Synonyms: (2Z)-3-[3-chloro-5-methoxy-4-(2-phenoxyethoxy)phenyl]-2-(3,4-dimethoxyphenyl)prop-2-enenitrile
Smiles: COc1cc(/C=C(/c2ccc(c(c2)OC)OC)\C#N)cc(c1OCCOc1ccccc1)Cl

STK056347
Synonyms: 2-[4-(acetylamino)phenoxy]-N-(5-chloro-2-methylphenyl)acetamide
Smiles: O=C(Nc1cc(Cl)ccc1C)COc1ccc(cc1)NC(=O)C

STK056362
Synonyms: 3-(bromoethynyl)benzoicacid
Smiles: BrC#Cc1cccc(c1)C(=O)O

STK056390
Synonyms: (2Z)-N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-[(4-methylphenyl)imino]-2H-chromene-3-carboxamide
Smiles: Cc1ccc(cc1)/N=c/1\oc2ccccc2cc1C(=O)Nc1scc(n1)c1ccc(cc1)C(C)(C)C

STK056399
Synonyms: (2-bromophenyl)[4-(2-hydroxyethyl)piperazin-1-yl]methanone
Smiles: OCCN1CCN(CC1)C(=O)c1ccccc1Br

STK056400
Synonyms: 4-[bis(phosphonomethyl)amino]butanoicacid
Smiles: OC(=O)CCCN(CP(=O)(O)O)CP(=O)(O)O

STK056432
Synonyms: 2-(2-cyclopropyl-2-oxoethoxy)benzonitrile
Smiles: N#Cc1ccccc1OCC(=O)C1CC1

STK056433
Synonyms: 3-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]pyridine
Smiles: Brc1ccc(cc1)c1noc(n1)c1cccnc1

STK056449
Synonyms: N-[5-(pyridin-4-yl)-1,3,4-thiadiazol-2-yl]-1,3-benzodioxole-5-carboxamide
Smiles: O=C(c1ccc2c(c1)OCO2)Nc1nnc(s1)c1ccncc1

STK056456
Synonyms: N-{2-[(2,2,4-trimethyl-4-phenyl-3,4-dihydroquinolin-1(2H)-yl)carbonyl]phenyl}benzamide
Smiles: O=C(c1ccccc1)Nc1ccccc1C(=O)N1c2ccccc2C(CC1(C)C)(C)c1ccccc1

STK056462
Synonyms: (4E)-4-[2-(3-hydroxyphenyl)hydrazinylidene]-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Oc1cccc(c1)N/N=C\1/C(=O)N(N=C1c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

STK056477
Synonyms: [3-cyclohexyl-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl](4-methylfuran-3-yl)methanone
Smiles: O=C(c1cocc1C)N1N=C(CC1(O)C(F)(F)F)C1CCCCC1

STK056512
Synonyms: ethyl(2Z)-2-{[1-(3,4-dichlorobenzyl)-1H-indol-3-yl]methylidene}-7-methyl-3-oxo-5-[4-(propan-2-yl)phenyl]-2,3,8,8a-tetrahydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)NC2N(C1c1ccc(cc1)C(C)C)C(=O)/C(=C/c1cn(c3c1cccc3)Cc1ccc(c(c1)Cl)Cl)/S2

STK056513
Synonyms: (2E,2'E)-1,1'-ethane-1,2-diylbis{2-[(4,5-dibromofuran-2-yl)methylidene]-1-methylhydrazine}
Smiles: CN(/N=C/c1oc(c(c1)Br)Br)CCN(/N=C/c1oc(c(c1)Br)Br)C

STK056523
Synonyms: 1-(4-bromophenyl)-N-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxamide
Smiles: CCc1cccc(c1NC(=O)C1CC(=O)N(C1)c1ccc(cc1)Br)CC

STK056532
Synonyms: 5-bromo-N,N-diethyl-6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-amine
Smiles: CCN(c1nn2c(s1)nc(c2Br)C)CC

STK056537
Synonyms: 3-cyclohexyl-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Smiles: O=c1[nH]c2sc3c(c2c(=O)n1C1CCCCC1)CCC3

STK056538
Synonyms: (6Z)-6-({1-[2-(3,5-dimethylphenoxy)ethyl]-1H-pyrrol-2-yl}methylidene)-5-imino-2-(3-methylphenyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Cc1cc(OCCn2cccc2/C=C/2\C(=O)N=c3n(C2=N)nc(s3)c2cccc(c2)C)cc(c1)C

STK056543
Synonyms: (5E)-3-benzyl-5-{4-[3-(4-tert-butylphenoxy)propoxy]-3-chloro-5-methoxybenzylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1cc(/C=C\2/SC(=S)N(C2=O)Cc2ccccc2)cc(c1OCCCOc1ccc(cc1)C(C)(C)C)Cl

STK056557
Synonyms: 2,4,6-trimethyl-N-(1,3-thiazol-2-yl)benzamide
Smiles: Cc1cc(C)c(c(c1)C)C(=O)Nc1nccs1

STK056558
Synonyms: ethyl5-(2-ethoxy-3-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)N=C2N(C1c1cccc(c1OCC)OC)C(=O)CS2

STK056560
Synonyms: (5s,7s)-5,7-dimethyl-2-propyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-ol
Smiles: CCCC1N2C[C@]3(CN1C[C@@](C2)(C3O)C)C

STK056572
Synonyms: propyl2-[(2-chlorophenyl)carbonyl]hydrazinecarboxylate
Smiles: CCCOC(=O)NNC(=O)c1ccccc1Cl

STK056579
Synonyms: [4-(4-bromophenyl)-2-(2-methoxyphenyl)-1,3-thiazol-5-yl]aceticacid
Smiles: COc1ccccc1c1sc(c(n1)c1ccc(cc1)Br)CC(=O)O

STK056589
Synonyms: 12-(6-hydroxy-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-8,10-dimethyl-8,12-dihydro-9H-benzo[5,6]chromeno[2,3-d]pyrimidine-9,11(10H)-dione
Smiles: Cn1c(O)c(C2c3c(ccc4c3cccc4)Oc3c2c(=O)n(c(=O)n3C)C)c(=O)n(c1=O)C

STK056592
Synonyms: 4-(4-bromophenyl)-2-(2-cyclopentylidenehydrazinyl)-1,3-thiazole
Smiles: Brc1ccc(cc1)c1csc(n1)NN=C1CCCC1

STK056603
Synonyms: N'-[(E)-{4-[3-(3,4-dimethylphenoxy)propoxy]-3-methoxyphenyl}methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)C)ccc1OCCCOc1ccc(c(c1)C)C

STK056613
Synonyms: pyridin-2-yl4-chlorobenzoate
Smiles: Clc1ccc(cc1)C(=O)Oc1ccccn1

STK056624
Synonyms: (2Z)-5-amino-2-(2-chlorobenzylidene)-7-(2-chlorophenyl)-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile
Smiles: N#CC1=C(N)n2c(=C(C1c1ccccc1Cl)C#N)s/c(=C\c1ccccc1Cl)/c2=O

STK056629
Synonyms: 7-(2-chloro-6-fluorobenzyl)-8-[(2-hydroxyethyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCNc1nc2c(n1Cc1c(F)cccc1Cl)c(=O)n(c(=O)n2C)C

STK056641
Synonyms: 2-(4-chlorophenyl)-4-[3-(2,6-difluorophenyl)-1,2,4-oxadiazol-5-yl]quinoline
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(c1)c1onc(n1)c1c(F)cccc1F

STK056648
Synonyms: 2-methoxy-N-(2-methylquinolin-5-yl)benzamide
Smiles: COc1ccccc1C(=O)Nc1cccc2c1ccc(n2)C

STK056662
Synonyms: 2-(methylsulfanyl)-3-(prop-2-en-1-yl)quinazolin-4(3H)-one
Smiles: C=CCn1c(SC)nc2c(c1=O)cccc2

STK056672
Synonyms: 2-{[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-6-ethyl-3-phenyl-2,3-dihydrothieno[2,3-d]pyrimidin-4(1H)-one
Smiles: COc1cc(ccc1OC)C(=O)CSC1Nc2sc(cc2C(=O)N1c1ccccc1)CC

STK056679
Synonyms: methyl[(methylamino)methyl]phosphinicacid
Smiles: CNCP(=O)(O)C

STK056680
Synonyms: 8-bromo-3,7-dimethyl-1-(oxiran-2-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(Br)nc2c1c(=O)n(CC1CO1)c(=O)n2C

STK056687
Synonyms: 4-[(2-chlorophenyl){1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl]morpholine
Smiles: Clc1ccccc1C(c1nnnn1c1cccc(c1)C(F)(F)F)N1CCOCC1

STK056722
Synonyms: N-{[2-(3-fluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-2-nitrobenzamide
Smiles: S=C(NC(=O)c1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)nc(o2)c1cccc(c1)F

STK056736
Synonyms: N-methyl-2-[4-({4-[4-methyl-3-(piperidin-1-ylsulfonyl)phenyl]phthalazin-1-yl}amino)phenoxy]acetamide
Smiles: CNC(=O)COc1ccc(cc1)Nc1nnc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)N1CCCCC1)C

STK056751
Synonyms: 1-(piperidin-1-yl)propan-2-yl3,4,5-trimethoxybenzoate
Smiles: COc1cc(cc(c1OC)OC)C(=O)OC(CN1CCCCC1)C

STK056752
Synonyms: 7-heptyl-3-methyl-8-(pentylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCn1c(SCCCCC)nc2c1c(=O)[nH]c(=O)n2C

STK056764
Synonyms: 3,4-dichloro-N-[4-(trifluoromethoxy)phenyl]benzamide
Smiles: O=C(c1ccc(c(c1)Cl)Cl)Nc1ccc(cc1)OC(F)(F)F

STK056779
Synonyms: 1-[3-(propan-2-yl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]ethanone
Smiles: CC(C1N(N=C2C1CCCC2)C(=O)C)C

STK056784
Synonyms: 2-methoxy-3-[(2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]phenyl4-methylbenzenesulfonate
Smiles: COc1c(cccc1OS(=O)(=O)c1ccc(cc1)C)C=C1C(=O)NC(=O)NC1=O

STK056812
Synonyms: 9-(2,6-dimethyl-2,5-dihydropyridazin-4-yl)-3,3,6,6-tetramethyl-10-(4-methylphenyl)decahydroacridine-1,8(2H,5H)-dione
Smiles: O=C1CC(C)(C)CC2C1C(C1=CN(N=C(C1)C)C)C1C(=O)CC(CC1N2c1ccc(cc1)C)(C)C

STK056860
Synonyms: N-(3-methoxyphenyl)-2-{[(3-nitrophenyl)carbonyl]amino}benzamide
Smiles: COc1cccc(c1)NC(=O)c1ccccc1NC(=O)c1cccc(c1)[N+](=O)[O-]

STK056909
Synonyms: 2-(4-chlorophenyl)-N-{[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl}acetamide
Smiles: COc1cc(ccc1OC)c1csc(n1)NC(=S)NC(=O)Cc1ccc(cc1)Cl

STK056972
Synonyms: 2-{[6-tert-butyl-3-cyano-4-(thiophen-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(3-fluorophenyl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2cccc(c2)F)nc2c(c1c1cccs1)CC(CC2)C(C)(C)C

STK056978
Synonyms: (6Z)-6-{4-[(2,4-dichlorobenzyl)oxy]-5-methoxy-2-nitrobenzylidene}-5-imino-2-methyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1cc(/C=C/2\C(=O)N=c3n(C2=N)nc(s3)C)c(cc1OCc1ccc(cc1Cl)Cl)[N+](=O)[O-]

STK057014
Synonyms: 2-(1H-pyrrol-2-yl)pyridine
Smiles: c1ccc(nc1)c1ccc[nH]1

STK057022
Synonyms: 1-[3-oxo-2-(2-oxopyridin-1(2H)-yl)-3-phenylpropanoyl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide
Smiles: O=C(C1CCN(CC1)C(=O)C(n1ccccc1=O)C(=O)c1ccccc1)NCc1cccnc1

STK057031
Synonyms: 1-(morpholin-4-yl)propan-2-yl1,3-benzodioxole-5-carboxylate
Smiles: CC(OC(=O)c1ccc2c(c1)OCO2)CN1CCOCC1

STK057042
Synonyms: 3-bromo-N-[3-chloro-4-(morpholin-4-yl)phenyl]-4-methoxybenzamide
Smiles: COc1ccc(cc1Br)C(=O)Nc1ccc(c(c1)Cl)N1CCOCC1

STK057043
Synonyms: N-benzyl-3-(4-fluorophenyl)-N-(2-hydroxyethyl)-3-oxo-2-(2-oxopyridin-1(2H)-yl)propanamide
Smiles: OCCN(C(=O)C(n1ccccc1=O)C(=O)c1ccc(cc1)F)Cc1ccccc1

STK057055
Synonyms: 5-ethoxy-5-(hex-1-yn-1-yl)-2,2,3-trimethylbicyclo[2.2.1]heptane
Smiles: CCCCC#CC1(OCC)CC2CC1C(C2(C)C)C

STK057074
Synonyms: 2-{(2E)-2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl}-4,5-dimethyl-1,3-thiazole
Smiles: COc1ccc(cc1)/C(=N/Nc1sc(c(n1)C)C)/C

STK057084
Synonyms: N-tert-butyl-4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-(4-methoxybenzyl)butanamide
Smiles: COc1ccc(cc1)CN(C(C)(C)C)C(=O)CCCN1C(=O)c2c(C1=O)cccc2

STK057100
Synonyms: 1H-benzimidazol-1-yl(2-chlorophenyl)methanone
Smiles: Clc1ccccc1C(=O)n1cnc2c1cccc2

STK057121
Synonyms: N-[2-(diethylamino)ethyl]-N'-(4-fluorobenzyl)butanediamide
Smiles: CCN(CCNC(=O)CCC(=O)NCc1ccc(cc1)F)CC

STK057124
Synonyms: methyl4-[10-acetyl-1-hydroxy-3-(4-methylphenyl)-3,4,10,11-tetrahydro-2H-dibenzo[b,e][1,4]diazepin-11-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C)cccc2)c1ccc(cc1)C

STK057127
Synonyms: 5-bromo-2-chloro-N-(pyridin-2-ylcarbamothioyl)benzamide
Smiles: S=C(NC(=O)c1cc(Br)ccc1Cl)Nc1ccccn1

STK057129
Synonyms: dipotassium2-[({4-[(1E)-3,3-diethyltriaz-1-en-1-yl]phenyl}sulfonyl)azanidyl]-3-phenylpropanoate
Smiles: CCN(/N=N/c1ccc(cc1)S(=O)(=O)[N-]C(C(=O)[O-])Cc1ccccc1)CC.[K+].[K+]

STK057131
Synonyms: 1-(2-hydroxy-3-methoxybenzyl)-N-(tetrahydrofuran-2-ylmethyl)piperidine-4-carboxamide
Smiles: COc1cccc(c1O)CN1CCC(CC1)C(=O)NCC1CCCO1

STK057138
Synonyms: 4-ethyl-2,6-dimethylpyridine-3,5-dicarboxylicacid
Smiles: CCc1c(C(=O)O)c(C)nc(c1C(=O)O)C

STK057139
Synonyms: 3-(2-chlorophenyl)-N-(4,5-dihydro-1,3-thiazol-2-yl)-5-methyl-1,2-oxazole-4-carboxamide
Smiles: O=C(c1c(C)onc1c1ccccc1Cl)NC1=NCCS1

STK057158
Synonyms: (2Z)-2-(3H-indol-3-ylidene)-1-methyl-1,2-dihydroquinoline
Smiles: Cn1/c(=C/2\C=Nc3c2cccc3)/ccc2c1cccc2

STK057168
Synonyms: 2-(4'-octylbiphenyl-4-yl)-7H-benzo[e]perimidin-7-one
Smiles: CCCCCCCCc1ccc(cc1)c1ccc(cc1)c1nc2cccc3c2c(n1)c1ccccc1C3=O

STK057178
Synonyms: 4-chloro-2-[(3-chlorophenyl)carbamoyl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1C(=O)Nc1cccc(c1)Cl)Cl

STK057195
Synonyms: 2-methyl-9-(trifluoromethyl)-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazoline
Smiles: Cc1cc2n(n1)c(c1c(n2)CCCC1)C(F)(F)F

STK057202
Synonyms: 2-[benzyl(methyl)amino]ethyl2-fluorobenzoate
Smiles: CN(Cc1ccccc1)CCOC(=O)c1ccccc1F

STK057226
Synonyms: 2-methoxy-N-{1-[(2-methoxyphenyl)carbonyl]-2-methyl-1,2,3,4-tetrahydroquinolin-4-yl}-N-phenylbenzamide
Smiles: COc1ccccc1C(=O)N1C(C)CC(c2c1cccc2)N(C(=O)c1ccccc1OC)c1ccccc1

STK057246
Synonyms: (3Z,3'Z)-3,3'-[ethane-1,2-diylbis(4-oxo-2-thioxo-1,3-thiazolidin-3-yl-5-ylidene)]bis(1,3-dihydro-2H-indol-2-one)
Smiles: S=C1S/C(=C/2\C(=O)Nc3c2cccc3)/C(=O)N1CCN1C(=S)S/C(=C/2\C(=O)Nc3c2cccc3)/C1=O

STK057267
Synonyms: 1-(4-hydroxy-3,5-dimethoxybenzyl)piperidine-4-carboxylicacid
Smiles: COc1cc(CN2CCC(CC2)C(=O)O)cc(c1O)OC

STK057278
Synonyms: (9R)-9-(4-hydroxy-3,5-dimethoxyphenyl)-8-oxo-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl4,6-O-[(1S)-ethylidene]-beta-D-allopyranoside
Smiles: COc1cc(cc(c1O)OC)[C@H]1C2C(=O)OCC2C(c2c1cc1OCOc1c2)O[C@@H]1O[C@@H]2CO[C@@H](O[C@H]2[C@H]([C@H]1O)O)C

STK057288
Synonyms: 6-amino-4-(3,4-dimethoxyphenyl)-3-ethyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(c(c1)OC)OC)c(CC)n[nH]2

STK057290
Synonyms: N-[(Z)-[(6-ethoxy-4-methylquinazolin-2-yl)amino](propanoylamino)methylidene]propanamide
Smiles: CCOc1ccc2c(c1)c(C)nc(n2)N/C(=N/C(=O)CC)/NC(=O)CC

STK057308
Synonyms: 2-bromo-N-{(4E)-4-[4-(dimethylamino)benzylidene]-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl}benzamide
Smiles: CN(c1ccc(cc1)/C=C\1/N=C(N(C1=O)NC(=O)c1ccccc1Br)c1ccccc1)C

STK057355
Synonyms: methyl3-({2-[2-(4-chlorophenyl)ethyl]-3-oxo-2,3-dihydro-1H-isoindol-1-yl}amino)-3-[4-(methylsulfanyl)phenyl]propanoate
Smiles: COC(=O)CC(c1ccc(cc1)SC)NC1c2ccccc2C(=O)N1CCc1ccc(cc1)Cl

STK057361
Synonyms: 2,2'-(biphenyl-2,2'-diyldicarbamoyl)dibenzoicacid
Smiles: O=C(c1ccccc1C(=O)O)Nc1ccccc1c1ccccc1NC(=O)c1ccccc1C(=O)O

STK057364
Synonyms: 2-chloro-N-{[4-(3,5-dimethyl-1H-pyrazol-1-yl)-6-methyl-1,3,5-triazin-2-yl]carbamoyl}benzenesulfonamide
Smiles: Cc1nc(NC(=O)NS(=O)(=O)c2ccccc2Cl)nc(n1)n1nc(cc1C)C

STK057389
Synonyms: N,N-dibenzyl-1-(2,4-dichlorophenyl)-1-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]methanamine
Smiles: Clc1ccc(c(c1)Cl)C(c1nnnn1c1c(C)cccc1C)N(Cc1ccccc1)Cc1ccccc1

STK057403
Synonyms: 2-{[5-(acetylamino)-1,3,4-thiadiazol-2-yl]sulfanyl}-N-(2-methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nnc(s1)NC(=O)C

STK057477
Synonyms: N~2~-[3,4-dimethyl-5-oxo-1-(2-phenylethyl)-2,5-dihydro-1H-pyrrol-2-yl]glycinamide
Smiles: NC(=O)CNC1C(=C(C(=O)N1CCc1ccccc1)C)C

STK057505
Synonyms: 1-methylpiperidin-3-yl2,3-dihydro-1,4-benzodioxine-6-carboxylate
Smiles: CN1CCCC(C1)OC(=O)c1ccc2c(c1)OCCO2

STK057508
Synonyms: methyl(2E)-4-({4-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl}amino)-4-oxobut-2-enoate
Smiles: COC(=O)/C=C/C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nnc(s1)CC

STK057581
Synonyms: 4-{[(2E)-2-cyano-3-(2,3-dimethoxyphenyl)prop-2-enoyl]amino}benzoicacid
Smiles: N#C/C(=C\c1cccc(c1OC)OC)/C(=O)Nc1ccc(cc1)C(=O)O

STK057589
Synonyms: 2-(4-fluorophenyl)-1-(10H-phenothiazin-10-yl)ethanone
Smiles: Fc1ccc(cc1)CC(=O)N1c2ccccc2Sc2c1cccc2

STK057599
Synonyms: 2-(iodoethynyl)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
Smiles: IC#CC1(O)CC2C(C1(C)CC2)(C)C

STK057612
Synonyms: 4-{[(E)-(4-hydroxyphenyl)methylidene]amino}-N-(2,4,6-trimethylphenyl)benzenesulfonamide
Smiles: Oc1ccc(cc1)/C=N/c1ccc(cc1)S(=O)(=O)Nc1c(C)cc(cc1C)C

STK057620
Synonyms: (5E)-5-(2-hydroxy-3-nitrobenzylidene)-2-thioxoimidazolidin-4-one
Smiles: [O-][N+](=O)c1cccc(c1O)/C=C\1/NC(=S)NC1=O

STK057652
Synonyms: N-(4-methoxy-2-nitrophenyl)pyridine-3-carboxamide
Smiles: COc1ccc(c(c1)[N+](=O)[O-])NC(=O)c1cccnc1

STK057680
Synonyms: 6-amino-4-{3-ethoxy-4-[(2-methylbenzyl)oxy]phenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCOc1cc(ccc1OCc1ccccc1C)C1C(=C(N)Oc2c1c(C)n[nH]2)C#N

STK057694
Synonyms: N~4~,N~6~-di(butan-2-yl)-N~2~,N~2~-dimethyl-1,3,5-triazine-2,4,6-triamine
Smiles: CCC(Nc1nc(NC(CC)C)nc(n1)N(C)C)C

STK057705
Synonyms: N-methylmethanaminium(2E)-1,1,5,5-tetracyanopenta-2,4-dien-1-ide
Smiles: N#C[C-](/C=C/C=C(C#N)C#N)C#N.C[NH2+]C

STK057717
Synonyms: (4Z)-2-(1,3-benzothiazol-2-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-4-(2,3-dimethoxybenzylidene)-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1c(cccc1OC)/C=C\1/C(=NN(C1=O)c1nc2c(s1)cccc2)CSc1ccc(cc1)Cl

STK057725
Synonyms: 2-(4-chlorophenyl)-5-cyclododecyl-1,2,4-triazolidine-3-thione
Smiles: Clc1ccc(cc1)N1NC(NC1=S)C1CCCCCCCCCCC1

STK057731
Synonyms: 3-ethyl-2,1-benzoxazole
Smiles: CCc1onc2c1cccc2

STK057750
Synonyms: N-(cyclopropylmethyl)-1-[3-(4-fluorophenyl)-3-oxo-2-(2-oxopyridin-1(2H)-yl)propanoyl]-N-propylpiperidine-4-carboxamide
Smiles: CCCN(C(=O)C1CCN(CC1)C(=O)C(n1ccccc1=O)C(=O)c1ccc(cc1)F)CC1CC1

STK057754
Synonyms: N'-[(E)-(2-chlorophenyl)methylidene]-3-(4-methylphenyl)-1H-pyrazole-5-carbohydrazide
Smiles: Cc1ccc(cc1)c1n[nH]c(c1)C(=O)N/N=C/c1ccccc1Cl

STK057775
Synonyms: N-{2,5-dimethoxy-4-[(phenylcarbonyl)amino]phenyl}-N'-(pyridin-3-yl)butanediamide
Smiles: COc1cc(NC(=O)c2ccccc2)c(cc1NC(=O)CCC(=O)Nc1cccnc1)OC

STK057778
Synonyms: N-[2-cyano-1-(4-methoxyphenyl)-1H-benzo[f]chromen-3-yl]benzamide
Smiles: N#CC1=C(Oc2c(C1c1ccc(cc1)OC)c1ccccc1cc2)NC(=O)c1ccccc1

STK057780
Synonyms: 1H-benzimidazol-1-yl(2,4-dichlorophenyl)methanone
Smiles: Clc1ccc(c(c1)Cl)C(=O)n1cnc2c1cccc2

STK057781
Synonyms: 4-{2-[(2-ethoxyphenyl)amino]-1,3-thiazol-4-yl}benzene-1,2-diol
Smiles: CCOc1ccccc1Nc1scc(n1)c1ccc(c(c1)O)O

STK057798
Synonyms: 2-(furan-2-yl)-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4-ol
Smiles: OC1=NC(Nc2c1c1CCCCc1s2)c1ccco1

STK057812
Synonyms: 3-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)amino]benzoicacid
Smiles: OC(=O)c1cccc(c1)Nc1ncnc2c1cnn2C

STK057867
Synonyms: N,N'-biphenyl-4,4'-diyldicyclopropanecarboxamide
Smiles: O=C(C1CC1)Nc1ccc(cc1)c1ccc(cc1)NC(=O)C1CC1

STK057871
Synonyms: 1-(4''-bromo-1,1':4',1''-terphenyl-4-yl)hexan-1-one
Smiles: CCCCCC(=O)c1ccc(cc1)c1ccc(cc1)c1ccc(cc1)Br

STK057883
Synonyms: 2-(1,3-benzothiazol-2-ylamino)-6-phenylpyrimidine-4-carboxylicacid
Smiles: OC(=O)c1nc(Nc2nc3c(s2)cccc3)nc(c1)c1ccccc1

STK057888
Synonyms: (4-hydroxy-6-methyl-5-phenoxypyrimidin-2-yl)cyanamide
Smiles: N#CNc1nc(C)c(c(n1)O)Oc1ccccc1

STK057909
Synonyms: N-[3-(diethylamino)propyl]-3-(3-nitrophenyl)-3-oxo-2-(2-oxopyridin-1(2H)-yl)propanamide
Smiles: CCN(CCCNC(=O)C(n1ccccc1=O)C(=O)c1cccc(c1)[N+](=O)[O-])CC

STK057910
Synonyms: 4-bromo-N-(4'-chlorobiphenyl-4-yl)benzamide
Smiles: Clc1ccc(cc1)c1ccc(cc1)NC(=O)c1ccc(cc1)Br

STK057913
Synonyms: (3E)-2-acetyl-3-[(4-acetylphenyl)imino]-6-nitro-2,3-dihydro-1H-inden-1-one
Smiles: CC(=O)c1ccc(cc1)/N=C/1\C(C(=O)C)C(=O)c2c1ccc(c2)[N+](=O)[O-]

STK057930
Synonyms: 2-[(4-aminophenyl)sulfanyl]-1-(3-nitrophenyl)ethanone
Smiles: Nc1ccc(cc1)SCC(=O)c1cccc(c1)[N+](=O)[O-]

STK057933
Synonyms: 2-[1-(3-methylphenyl)-1H-tetrazol-5-yl]butan-2-amine
Smiles: CCC(c1nnnn1c1cccc(c1)C)(N)C

STK057941
Synonyms:
Smiles: CCOc1cc(ccc1O)/C=N/n1c[nH]nc1

STK057942
Synonyms: 5-(3,4-dimethoxyphenyl)-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole
Smiles: COc1cc(ccc1OC)c1onc(n1)c1cccc(c1)C(F)(F)F

STK057956
Synonyms: (5E)-1-(3-chlorophenyl)-5-(4-fluorobenzylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: Fc1ccc(cc1)/C=C/1\C(=O)NC(=S)N(C1=O)c1cccc(c1)Cl

STK057964
Synonyms: 3-ethoxy-N-(6-methylpyridin-2-yl)benzamide
Smiles: CCOc1cccc(c1)C(=O)Nc1cccc(n1)C

STK057979
Synonyms: 7-methyl-3-phenyl-2-thioxo-2,3,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one
Smiles: CN1CCc2c(C1)sc1c2c(=O)n(c(=S)[nH]1)c1ccccc1

STK058011
Synonyms: N-(3,4-dimethylphenyl)-5-{[(4-methylphenyl)carbonyl]amino}-1-phenyl-1H-pyrazole-4-carboxamide
Smiles: Cc1ccc(cc1)C(=O)Nc1c(cnn1c1ccccc1)C(=O)Nc1ccc(c(c1)C)C

STK058015
Synonyms: 5-bromo-2-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide
Smiles: Brc1ccc(c(c1)C(=O)Nc1nc(C)cc(n1)C)Cl

STK058017
Synonyms: 3-(4-chlorophenyl)-3-[(4-ethylphenyl)amino]-1-(4-methylphenyl)propan-1-one
Smiles: CCc1ccc(cc1)NC(c1ccc(cc1)Cl)CC(=O)c1ccc(cc1)C

STK058033
Synonyms: 3-({[(2-methoxyphenyl)carbonyl]carbamothioyl}amino)-2-methylbenzoicacid
Smiles: COc1ccccc1C(=O)NC(=S)Nc1cccc(c1C)C(=O)O

STK058036
Synonyms: 2-amino-6-ethyl-7-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Smiles: CCc1c(C)nc2n(c1=O)nc(s2)N

STK058043
Synonyms: (4-{(Z)-[(2Z)-3-benzyl-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}phenoxy)aceticacid
Smiles: OC(=O)COc1ccc(cc1)/C=C/1\S/C(=N\c2ccccc2)/N(C1=O)Cc1ccccc1

STK058062
Synonyms: 2-(2,5-dioxo-1-phenylpyrrolidin-3-yl)hydrazinecarboxamide
Smiles: NC(=O)NNC1CC(=O)N(C1=O)c1ccccc1

STK058090
Synonyms: 2-[(4-hydroxy-6-phenylpyrimidin-2-yl)sulfanyl]-1-(6-methoxy-2,2,4-trimethylquinolin-1(2H)-yl)ethanone
Smiles: COc1ccc2c(c1)C(=CC(N2C(=O)CSc1nc(O)cc(n1)c1ccccc1)(C)C)C

STK058125
Synonyms: N-{[3-(butanoylamino)phenyl]carbamothioyl}-2-fluorobenzamide
Smiles: CCCC(=O)Nc1cccc(c1)NC(=S)NC(=O)c1ccccc1F

STK058136
Synonyms: N'-[(4-phenylcyclohexyl)carbonyl]biphenyl-4-carbohydrazide
Smiles: O=C(C1CCC(CC1)c1ccccc1)NNC(=O)c1ccc(cc1)c1ccccc1

STK058166
Synonyms: [5-(benzyloxy)-2-methyl-1-benzofuran-3-yl]methanol
Smiles: OCc1c(C)oc2c1cc(OCc1ccccc1)cc2

STK058180
Synonyms: [4-amino-2-(ethylamino)-1,3-thiazol-5-yl](tricyclo[3.3.1.1~3,7~]dec-1-yl)methanone
Smiles: CCNc1sc(c(n1)N)C(=O)C12CC3CC(C2)CC(C1)C3

STK058182
Synonyms: (5Z)-2H-[1,3,5,6]thiatriazocino[3,2-a]benzimidazol-3(4H)-one
Smiles: O=C1NN=Cn2c(SC1)nc1c2cccc1

STK058215
Synonyms: 5-acetyl-2-amino-4-methylthiophene-3-carboxamide
Smiles: CC(=O)c1sc(c(c1C)C(=O)N)N

STK058220
Synonyms: 6-(1,3-benzoxazol-2-ylsulfanyl)-N,N'-bis(4-chlorophenyl)-1,3,5-triazine-2,4-diamine
Smiles: Clc1ccc(cc1)Nc1nc(Nc2ccc(cc2)Cl)nc(n1)Sc1nc2c(o1)cccc2

STK058226
Synonyms: 1-{N-methyl-N-[(4-methylphenyl)sulfonyl]glycyl}piperidine-4-carboxamide
Smiles: CN(S(=O)(=O)c1ccc(cc1)C)CC(=O)N1CCC(CC1)C(=O)N

STK058229
Synonyms: ethyl[(3-benzyl-6-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
Smiles: CCOC(=O)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CC(CC3)C

STK058233
Synonyms: (5Z)-5-(2-methoxybenzylidene)imidazolidine-2,4-dione
Smiles: COc1ccccc1/C=C/1\NC(=O)NC1=O

STK058236
Synonyms: 5-[(1H-benzimidazol-2-ylsulfanyl)acetyl]-5-methyl-3-(2-methylpropyl)dihydrofuran-2(3H)-one(non-preferredname)
Smiles: CC(CC1CC(OC1=O)(C)C(=O)CSc1nc2c([nH]1)cccc2)C

STK058239
Synonyms: 6-hydroxy-2-[(pentafluorobenzyl)sulfanyl]pyrimidin-4(3H)-one
Smiles: Oc1cc(=O)[nH]c(n1)SCc1c(F)c(F)c(c(c1F)F)F

STK058245
Synonyms: 1-[3-(4-fluorophenyl)-3-oxo-2-(2-oxopyridin-1(2H)-yl)propanoyl]-N-(2-phenylethyl)piperidine-4-carboxamide
Smiles: Fc1ccc(cc1)C(=O)C(n1ccccc1=O)C(=O)N1CCC(CC1)C(=O)NCCc1ccccc1

STK058305
Synonyms: 7-benzyl-4-[(2E)-2-(4-fluorobenzylidene)hydrazinyl]-2-(methylsulfanyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CSc1nc(N/N=C/c2ccc(cc2)F)c2c(n1)sc1c2CCN(C1)Cc1ccccc1

STK058330
Synonyms: (6Z)-6-{4-[2-(4-bromophenoxy)ethoxy]-3-ethoxy-5-iodobenzylidene}-5-imino-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Smiles: CCOc1cc(cc(c1OCCOc1ccc(cc1)Br)I)/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1

STK058342
Synonyms: 1-(2-{[4,6-bis(diethylamino)-1,3,5-triazin-2-yl]oxy}ethyl)-3-phenylurea
Smiles: CCN(c1nc(OCCNC(=O)Nc2ccccc2)nc(n1)N(CC)CC)CC

STK058345
Synonyms: (4E)-4-{2-[2-(3,4-dimethylphenoxy)ethoxy]-5-methylbenzylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Cc1ccc(c(c1)/C=C/1\C(=NN(C1=O)c1ccccc1)C)OCCOc1ccc(c(c1)C)C

STK058369
Synonyms: 1-[2-(1,3-benzodioxol-5-yl)ethyl]-3-(3-methoxybenzyl)pyrrolidine-2,5-dione
Smiles: COc1cccc(c1)CC1CC(=O)N(C1=O)CCc1ccc2c(c1)OCO2

STK058403
Synonyms: 1-(naphthalen-1-ylmethyl)azepane
Smiles: C1CCCN(CC1)Cc1cccc2c1cccc2

STK058418
Synonyms: 2-[(diprop-2-en-1-ylamino)methyl]-6-methoxyphenol
Smiles: COc1cccc(c1O)CN(CC=C)CC=C

STK058426
Synonyms: 2-[(4-methylquinazolin-2-yl)amino]pyrimidine-4,6-diol
Smiles: Oc1cc(O)nc(n1)Nc1nc(C)c2c(n1)cccc2

STK058433
Synonyms: N-[3-(diethylamino)propyl]-4-(furan-2-yl)benzamide
Smiles: CCN(CCCNC(=O)c1ccc(cc1)c1ccco1)CC

STK058435
Synonyms: 4-bromo-2-[(E)-{2-[(naphthalen-1-ylamino)acetyl]hydrazinylidene}methyl]phenyl4-bromobenzoate(non-preferredname)
Smiles: O=C(CNc1cccc2c1cccc2)N/N=C/c1cc(Br)ccc1OC(=O)c1ccc(cc1)Br

STK058440
Synonyms: methyl{2-chloro-6-ethoxy-4-[(E)-(1-methyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]phenoxy}acetate
Smiles: CCOc1cc(/C=C/2\C(=O)NC(=S)N(C2=O)C)cc(c1OCC(=O)OC)Cl

STK058443
Synonyms: {4-[(E)-(biphenyl-2-ylimino)methyl]-5-hydroxy-6-methylpyridin-3-yl}methyldihydrogenphosphate
Smiles: Cc1ncc(c(c1O)/C=N/c1ccccc1c1ccccc1)COP(=O)(O)O

STK058444
Synonyms: 2-[5-(2-fluorophenyl)furan-2-yl]-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol
Smiles: CN1CCc2c(C1)sc1c2C(=NC(N1)c1ccc(o1)c1ccccc1F)O

STK058453
Synonyms: ethyl[4-bromo-3-(morpholin-4-ylmethyl)phenyl]acetate
Smiles: CCOC(=O)Cc1ccc(c(c1)CN1CCOCC1)Br

STK058464
Synonyms: 2-amino-4-(2,6-dichlorophenyl)-5,7-dihydroxy-4H-chromene-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1c(Cl)cccc1Cl)c(O)cc(c2)O

STK058469
Synonyms: 4-{[(E)-(2,4-dihydroxyphenyl)methylidene]amino}benzonitrile
Smiles: N#Cc1ccc(cc1)/N=C/c1ccc(cc1O)O

STK058470
Synonyms: 2-(3-amino-2-imino-2,3-dihydro-1H-benzimidazol-1-yl)-1-(4-bromophenyl)ethanone
Smiles: Brc1ccc(cc1)C(=O)Cn1c(=N)n(c2c1cccc2)N

STK058476
Synonyms: 2,6-dimethoxy-N-(3-methylphenyl)benzamide
Smiles: COc1cccc(c1C(=O)Nc1cccc(c1)C)OC

STK058504
Synonyms: (6Z)-6-{3-bromo-4-[2-(4-chloro-3-methylphenoxy)ethoxy]-5-methoxybenzylidene}-5-imino-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1cc(cc(c1OCCOc1ccc(c(c1)C)Cl)Br)/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1

STK058520
Synonyms: N-(4-nitrophenyl)-N'-(1-phenylethyl)butanediamide
Smiles: CC(c1ccccc1)NC(=O)CCC(=O)Nc1ccc(cc1)[N+](=O)[O-]

STK058552
Synonyms: 4-methyl-2-(3-oxo-3H-benzo[f]chromen-2-yl)-5H-benzo[5,6]chromeno[3,4-c]pyridin-5-one
Smiles: O=c1oc2ccc3c(c2cc1c1nc(C)c2c(c1)c1c(oc2=O)ccc2c1cccc2)cccc3

STK058578
Synonyms: N-tert-butyl-4-methoxy-N-(4-methylbenzyl)benzamide
Smiles: COc1ccc(cc1)C(=O)N(C(C)(C)C)Cc1ccc(cc1)C

STK058608
Synonyms: (6Z)-6-(5-bromo-2-hydroxybenzylidene)-5-imino-2-(phenoxymethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Brc1ccc(c(c1)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)COc1ccccc1)O

STK058641
Synonyms: sodium3-ethynylbenzoate
Smiles: [Na]OC(=O)c1cccc(c1)C#C

STK058652
Synonyms: (4E)-5-(4-nitrophenyl)-2-phenyl-4-(2-phenylhydrazinylidene)-2,4-dihydro-3H-pyrazol-3-one
Smiles: O=C1N(N=C(/C/1=N\Nc1ccccc1)c1ccc(cc1)[N+](=O)[O-])c1ccccc1

STK058689
Synonyms: ({2-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]propanoyl}amino)(phenyl)aceticacid
Smiles: O=C(C(Oc1ccc2c(c1)oc(=O)cc2C)C)NC(c1ccccc1)C(=O)O

STK058698
Synonyms: 2-(2,4-dichlorophenoxy)-N-methyl-N-phenylacetamide
Smiles: Clc1ccc(c(c1)Cl)OCC(=O)N(c1ccccc1)C

STK058711
Synonyms: (2E)-2-(3,5-dichloro-4-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}benzylidene)hydrazinecarboxamide
Smiles: C=CCc1ccccc1OCCOc1c(Cl)cc(cc1Cl)/C=N/NC(=O)N

STK058724
Synonyms: 3-[4-(4-propylcyclohexyl)phenyl]-1,2,4-oxadiazol-5-ylbenzoate
Smiles: CCCC1CCC(CC1)c1ccc(cc1)c1noc(n1)OC(=O)c1ccccc1

STK058730
Synonyms: 1-amino-N-(2-methoxyphenyl)-5-methyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide
Smiles: COc1ccccc1NC(=O)c1sc2c(c1N)c1CCCCc1c(n2)C

STK058766
Synonyms: 3-(2,3-dihydro-1H-indol-1-ylcarbonyl)-8,8-dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-2-carboxylicacid
Smiles: OC(=O)C1CC2=C(CC1C(=O)N1CCc3c1cccc3)CCCC2(C)C

STK058767
Synonyms: N-{(2Z)-3-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-chromen-2-ylidene}-1,3-thiazol-2-amine
Smiles: COc1cccc2c1o/c(=N\c1nccs1)/c(c2)c1scc(n1)c1ccc(cc1)Br

STK058770
Synonyms: (2E)-1-(2,4-dichlorophenyl)-3-[(2,6-dimethylphenyl)amino]prop-2-en-1-one
Smiles: Clc1ccc(c(c1)Cl)C(=O)/C=C/Nc1c(C)cccc1C

STK058779
Synonyms: 3-cyclohexyl-6,6-dimethyl-2-[(2-methylprop-2-en-1-yl)sulfanyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC(=C)CSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CC(OC3)(C)C

STK058786
Synonyms: (5E)-1-(4-chlorophenyl)-5-{3-[2-(4-cyclohexylphenoxy)ethoxy]benzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Clc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2cccc(c2)OCCOc2ccc(cc2)C2CCCCC2)/C1=O

STK058787
Synonyms: 3-amino-3-[2-chloro-5-(trifluoromethyl)phenyl]propanoicacid
Smiles: NC(c1cc(ccc1Cl)C(F)(F)F)CC(=O)O

STK058798
Synonyms: N-ethyl-N-(2-methylprop-2-en-1-yl)-1-[3-(3-nitrophenyl)-3-oxo-2-(2-oxopyridin-1(2H)-yl)propanoyl]piperidine-4-carboxamide
Smiles: CCN(C(=O)C1CCN(CC1)C(=O)C(n1ccccc1=O)C(=O)c1cccc(c1)[N+](=O)[O-])CC(=C)C

STK058811
Synonyms: 2-(1,3-benzothiazol-2-ylsulfanyl)-N'-{(3Z)-2-oxo-1-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)methyl]-1,2-dihydro-3H-indol-3-ylidene}acetohydrazide
Smiles: O=C(N/N=C\1/c2ccccc2N(C1=O)CN1CC2(CC1CC(C2)(C)C)C)CSc1nc2c(s1)cccc2

STK058820
Synonyms: 2-bromo-N-[6-methyl-2-(4-methylphenyl)-2H-benzotriazol-5-yl]-5-nitrobenzamide
Smiles: Cc1ccc(cc1)n1nc2c(n1)cc(c(c2)C)NC(=O)c1cc(ccc1Br)[N+](=O)[O-]

STK058825
Synonyms: 2-({[(2,3-dichlorophenyl)carbonyl]carbamothioyl}amino)benzoicacid
Smiles: S=C(NC(=O)c1cccc(c1Cl)Cl)Nc1ccccc1C(=O)O

STK058842
Synonyms: 2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-(pyridin-2-ylmethyl)acetamide
Smiles: O=C(Cc1c(C)[nH]c2c1cc(F)cc2)NCc1ccccn1

STK058843
Synonyms: 6-methyl-2-(prop-2-en-1-ylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine
Smiles: C=CCSc1nc(N)c2c(n1)sc1c2CC(CC1)C

STK058844
Synonyms: 1-(2-chloro-6-fluorobenzyl)azepane
Smiles: Fc1cccc(c1CN1CCCCCC1)Cl

STK058878
Synonyms: 4-(1H-pyrrol-1-yl)phenyl3-nitrobenzoate
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])Oc1ccc(cc1)n1cccc1

STK058909
Synonyms: 8-(3-hydroxy-3-methylbutyl)-4,8-dimethoxy-4a,5,6,7,8,8a-hexahydrofuro[2,3-b]quinolin-7-ol
Smiles: COC1=c2ccoc2=NC2C1CCC(C2(OC)CCC(O)(C)C)O

STK058917
Synonyms: 2-{[2-(pyridin-2-yl)ethyl]sulfanyl}benzoicacid
Smiles: OC(=O)c1ccccc1SCCc1ccccn1

STK058921
Synonyms: 1-[5-hydroxy-3-pentyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-methylpropan-1-one
Smiles: CCCCCC1=NN(C(C1)(O)C(F)(F)F)C(=O)C(C)C

STK058928
Synonyms: methyl3-[1-benzyl-2-(ethylsulfanyl)-3,4-dimethyl-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]propanoate
Smiles: CCSC1(CCC(=O)OC)C(=C(C(=O)N1Cc1ccccc1)C)C

STK058941
Synonyms: 2-bromo-N'-[(1E)-1-(7-hydroxy-2-oxo-2H-chromen-3-yl)ethylidene]benzohydrazide
Smiles: Oc1ccc2c(c1)oc(=O)c(c2)/C(=N/NC(=O)c1ccccc1Br)/C

STK058946
Synonyms: potassium4-[(E)-piperazin-1-yldiazenyl]benzenesulfonate
Smiles: [O-]S(=O)(=O)c1ccc(cc1)/N=N/N1CCNCC1.[K+]

STK058957
Synonyms: 3-{(1E)-1-[2-(4-nitrophenyl)hydrazinylidene]-2-phenylethyl}-1H-indole
Smiles: [O-][N+](=O)c1ccc(cc1)N/N=C(/c1c[nH]c2c1cccc2)\Cc1ccccc1

STK058958
Synonyms: 2-(azepan-1-ylcarbonyl)phenylacetate
Smiles: CC(=O)Oc1ccccc1C(=O)N1CCCCCC1

STK058993
Synonyms: {(7E)-7-[4-(dimethylamino)benzylidene]-3-[4-(dimethylamino)phenyl]-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl}(pyridin-2-yl)methanone
Smiles: CN(c1ccc(cc1)/C=C/1\CCCC2C1=NN(C2c1ccc(cc1)N(C)C)C(=O)c1ccccn1)C

STK059037
Synonyms: N'-(acridin-9-yl)-2,4-dihydroxybenzohydrazide
Smiles: Oc1ccc(c(c1)O)C(=O)NNc1c2ccccc2nc2c1cccc2

STK059075
Synonyms: 2-methoxy-N-(4-nitrophenyl)-2-phenylacetamide
Smiles: COC(c1ccccc1)C(=O)Nc1ccc(cc1)[N+](=O)[O-]

STK059084
Synonyms: 3-{4-[(7-methyloctyl)oxy]phenyl}pyrrolidine-2,5-dione
Smiles: CC(CCCCCCOc1ccc(cc1)C1CC(=O)NC1=O)C

STK059093
Synonyms: methyl1-methyl-6-nitro-1H-indole-2-carboxylate
Smiles: COC(=O)c1cc2c(n1C)cc(cc2)[N+](=O)[O-]

STK059110
Synonyms: 1,3-bis(2-methylphenyl)urea
Smiles: O=C(Nc1ccccc1C)Nc1ccccc1C

STK059139
Synonyms: N-(4-chlorobenzyl)-N-ethylethanamine
Smiles: CCN(Cc1ccc(cc1)Cl)CC

STK059150
Synonyms: 4-[tert-butyl(4-chlorobenzyl)amino]-4-oxobutanoicacid
Smiles: O=C(N(C(C)(C)C)Cc1ccc(cc1)Cl)CCC(=O)O

STK059153
Synonyms: 4,10-dichloronaphtho[7,8,1,2,3-nopqr]tetraphene-6,12-dione
Smiles: Clc1cc2c3c4c1cccc4c(=O)c1c3c3c(c2=O)cccc3c(c1)Cl

STK059161
Synonyms: 2-bromo-7-methyl-6-(oxido-lambda~5~-azanyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Smiles: [O-][NH+]c1c(C)nc2n(c1=O)nc(s2)Br

STK059180
Synonyms: N~2~,N~4~-di(butan-2-yl)-N~6~-methyl-1,3,5-triazine-2,4,6-triamine
Smiles: CCC(Nc1nc(NC(CC)C)nc(n1)NC)C

STK059225
Synonyms: 1-phenyl-4-[1-(pyridin-4-ylmethyl)piperidin-4-yl]piperazine
Smiles: c1ccc(cc1)N1CCN(CC1)C1CCN(CC1)Cc1ccncc1

STK059247
Synonyms: 2-iodo-N'-[(E)-(2-methyl-1H-indol-3-yl)methylidene]benzohydrazide
Smiles: O=C(c1ccccc1I)N/N=C/c1c(C)[nH]c2c1cccc2

STK059250
Synonyms: (5Z)-5-(2-hydroxybenzylidene)-2-(3-methylpiperidin-1-yl)-1,3-thiazol-4(5H)-one
Smiles: CC1CCCN(C1)C1=NC(=O)/C(=C/c2ccccc2O)/S1

STK059266
Synonyms: 8-[(2-methoxyethyl)amino]-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCNc1nc2c(n1C)c(=O)n(c(=O)n2C)C

STK059295
Synonyms: ethyl{[5-oxo-4-(phenylcarbonyl)-4,5,7,8-tetrahydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2C(=O)c1ccccc1)CCC3

STK059297
Synonyms: 5-chloro-4-{[(3,4-dimethoxyphenyl)carbonyl]amino}-2-methoxybenzoicacid
Smiles: COc1ccc(cc1OC)C(=O)Nc1cc(OC)c(cc1Cl)C(=O)O

STK059298
Synonyms: 2-[(4-chlorophenoxy)methyl]-1,3-benzoxazole
Smiles: Clc1ccc(cc1)OCc1nc2c(o1)cccc2

STK059305
Synonyms: 2-hexyl[1,3]oxazolo[4,5-c]quinolin-4(5H)-one
Smiles: CCCCCCc1nc2c(o1)c1ccccc1[nH]c2=O

STK059384
Synonyms: 2-(acetylamino)-N-(4-methylphenyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide
Smiles: CC(=O)Nc1sc2c(c1C(=O)Nc1ccc(cc1)C)CCC2

STK059393
Synonyms: 2-(acetylamino)-N,N-dipropyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Smiles: CCCN(C(=O)c1c(NC(=O)C)sc2c1CCCCC2)CCC

STK059397
Synonyms: N-(2-chlorophenyl)-5-oxo-1-[4-(propan-2-yl)phenyl]pyrrolidine-3-carboxamide
Smiles: O=C(C1CC(=O)N(C1)c1ccc(cc1)C(C)C)Nc1ccccc1Cl

STK059400
Synonyms: 4-chloro-2-[(4-chlorophenyl)carbamoyl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1C(=O)Nc1ccc(cc1)Cl)Cl

STK059406
Synonyms: (6Z)-6-{4-[2-(2-chlorophenoxy)ethoxy]-3-ethoxybenzylidene}-5-imino-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Smiles: CCOc1cc(ccc1OCCOc1ccccc1Cl)/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1

STK059408
Synonyms: 7-(2,5-dimethoxyphenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Smiles: COc1ccc(c(c1)C1N2C(=O)CSC2=NC2=C1CCc1c2cccc1)OC

STK059452
Synonyms: 3-chloro-N'-[(2E)-hexan-2-ylidene]benzohydrazide
Smiles: CCCC/C(=N/NC(=O)c1cccc(c1)Cl)/C

STK059455
Synonyms: N-(2,4-dinitrophenyl)ethane-1,2-diamine
Smiles: NCCNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

STK059458
Synonyms: (4E)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-methyl-4-[2-(4-methyl-3-nitrophenyl)hydrazinylidene]-2,4-dihydro-3H-pyrazol-3-one
Smiles: Brc1ccc(cc1)c1csc(n1)N1N=C(/C(=N\Nc2ccc(c(c2)[N+](=O)[O-])C)/C1=O)C

STK059466
Synonyms: [(3-cyclohexyl-4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetonitrile
Smiles: N#CCSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CCC3

STK059471
Synonyms: 2-(1H-benzotriazol-1-yl)-N'-[(E)-(3-bromophenyl)methylidene]acetohydrazide
Smiles: Brc1cccc(c1)/C=N/NC(=O)Cn1nnc2c1cccc2

STK059480
Synonyms: 2-({1-[4-(benzyloxy)-3-methoxyphenyl]-2-methoxy-2-oxoethyl}carbamoyl)cyclohexanecarboxylicacid
Smiles: COC(=O)C(c1ccc(c(c1)OC)OCc1ccccc1)NC(=O)C1CCCCC1C(=O)O

STK059490
Synonyms: 3-[(phenylamino)methyl]-1,3-benzothiazole-2(3H)-thione
Smiles: S=c1sc2c(n1CNc1ccccc1)cccc2

STK059492
Synonyms: [(7-methyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetonitrile
Smiles: N#CCSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCN(C3)C

STK059497
Synonyms: 1,3-benzoxazol-2-yl2,3,4,6-tetra-O-acetyl-1-thiohexopyranoside
Smiles: CC(=O)OCC1OC(Sc2nc3c(o2)cccc3)C(C(C1OC(=O)C)OC(=O)C)OC(=O)C

STK059525
Synonyms: 1-(1,3-benzodioxol-5-ylmethyl)-N-benzyl-N-ethylpiperidin-4-amine
Smiles: CCN(C1CCN(CC1)Cc1ccc2c(c1)OCO2)Cc1ccccc1

STK059560
Synonyms: N-(3-ethoxypropyl)-1-(pyridin-2-ylmethyl)piperidine-4-carboxamide
Smiles: CCOCCCNC(=O)C1CCN(CC1)Cc1ccccn1

STK059564
Synonyms: (2Z,5Z)-5-(1H-indol-3-ylmethylidene)-2-[(4-methylphenyl)imino]-3-propyl-1,3-thiazolidin-4-one
Smiles: CCCN1/C(=N/c2ccc(cc2)C)/S/C(=C\c2c[nH]c3c2cccc3)/C1=O

STK059575
Synonyms: 8-methyl-3,11-diphenyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: Cc1ccc2c(c1)NC(c1ccccc1)C1=C(N2)CC(CC1=O)c1ccccc1

STK059577
Synonyms: 5-bromo-N-{[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl}-2-methoxybenzamide
Smiles: COc1cc(ccc1OC)c1csc(n1)NC(=S)NC(=O)c1cc(Br)ccc1OC

STK059579
Synonyms: 4-(3,3-dimethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)phenylphenylacetate
Smiles: O=C(Cc1ccccc1)Oc1ccc(cc1)C1Nc2ccccc2NC2=C1C(=O)CC(C2)(C)C

STK059596
Synonyms: 7-dodecyl-8-[(3-hydroxypropyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCn1c(NCCCO)nc2c1c(=O)[nH]c(=O)n2C

STK059600
Synonyms: dimethyl2-(2-methoxy-2-oxoethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Smiles: COC(=O)C1=C(CC(=O)OC)NC(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)OC)C

STK059603
Synonyms: 2,2'-(phenylmethanediyl)bis(5,5-dimethylcyclohexane-1,3-dione)
Smiles: O=C1CC(C)(C)CC(=O)C1C(C1C(=O)CC(CC1=O)(C)C)c1ccccc1

STK059611
Synonyms: {4-[(E)-{2-[(3,5-dichloro-2-hydroxyphenyl)carbonyl]hydrazinylidene}methyl]-5-hydroxy-6-methylpyridin-3-yl}methyldihydrogenphosphate
Smiles: Clc1cc(Cl)c(c(c1)C(=O)N/N=C/c1c(cnc(c1O)C)COP(=O)(O)O)O

STK059619
Synonyms: 4-{[(E)-(2-methoxynaphthalen-1-yl)methylidene]amino}benzenesulfonamide
Smiles: COc1ccc2c(c1/C=N/c1ccc(cc1)S(=O)(=O)N)cccc2

STK059635
Synonyms: methylN-(4-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-4-oxobutanoyl)leucinate
Smiles: COC(=O)C(NC(=O)CCC(=O)NCCC1=CCCCC1)CC(C)C

STK059655
Synonyms: (2Z)-6-bromo-2-[(4-chlorophenyl)imino]-N-(pyridin-4-yl)-2H-chromene-3-carboxamide
Smiles: Brc1ccc2c(c1)cc(/c(=N/c1ccc(cc1)Cl)/o2)C(=O)Nc1ccncc1

STK059673
Synonyms: 5-(3-methylphenyl)-3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazole
Smiles: COc1cc(cc(c1OC)OC)c1noc(n1)c1cccc(c1)C

STK059691
Synonyms: (2Z)-4-oxo-2-(phenylimino)-N-(4-propoxyphenyl)-1,3-thiazinane-6-carboxamide
Smiles: CCCOc1ccc(cc1)NC(=O)C1CC(=O)N/C(=N/c2ccccc2)/S1

STK059692
Synonyms: 1-(9H-carbazol-9-yl)-3-[(tetrahydrofuran-2-ylmethyl)amino]propan-2-ol
Smiles: OC(Cn1c2ccccc2c2c1cccc2)CNCC1CCCO1

STK059705
Synonyms: 3-methyl-N-[(3-nitrophenyl)carbamothioyl]butanamide
Smiles: CC(CC(=O)NC(=S)Nc1cccc(c1)[N+](=O)[O-])C

STK059711
Synonyms: methyl2-({[4-(acetylamino)phenyl]sulfonyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCC2)NS(=O)(=O)c1ccc(cc1)NC(=O)C

STK059757
Synonyms: 1-(4-methoxyphenyl)-3-(5-methyl-1,3,4-thiadiazol-2-yl)urea
Smiles: COc1ccc(cc1)NC(=O)Nc1nnc(s1)C

STK059823
Synonyms: 2-(pyrrolidin-1-ylmethyl)pyridine
Smiles: C1CCN(C1)Cc1ccccn1

STK059846
Synonyms: (6E)-6-{3,5-dimethoxy-4-[2-(4-methylphenoxy)ethoxy]benzylidene}-5-imino-2-(2-methylphenyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1cc(/C=C\2/C(=O)N=c3n(C2=N)nc(s3)c2ccccc2C)cc(c1OCCOc1ccc(cc1)C)OC

STK059847
Synonyms: 2-oxo-2-phenylethylN'-cyano-N-phenylcarbamimidothioate
Smiles: N#C/N=C(\Nc1ccccc1)/SCC(=O)c1ccccc1

STK059882
Synonyms: methyl2-{[(2E)-4-methoxy-4-oxobut-2-enoyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Smiles: COC(=O)/C=C/C(=O)Nc1sc2c(c1C(=O)OC)CCC2

STK059898
Synonyms: (5E)-5-{(2E)-3-[4-(dimethylamino)phenyl]prop-2-en-1-ylidene}-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione
Smiles: C#CCN1C(=O)S/C(=C/C=C/c2ccc(cc2)N(C)C)/C1=O

STK059916
Synonyms: 2-[(4'-nitrobiphenyl-4-yl)amino]-1,3-thiazol-4(5H)-one
Smiles: O=C1CSC(=N1)Nc1ccc(cc1)c1ccc(cc1)[N+](=O)[O-]

STK059927
Synonyms: 2,3-dimethyl-1-(phenylsulfonyl)-1H-indole
Smiles: Cc1c2ccccc2n(c1C)S(=O)(=O)c1ccccc1

STK059943
Synonyms: [2-(2-hydroxy-4-nitrophenyl)hydrazinylidene]propanedinitrile
Smiles: N#CC(=NNc1ccc(cc1O)[N+](=O)[O-])C#N

STK059948
Synonyms: N-{(E)-amino[(4-methylquinazolin-2-yl)amino]methylidene}-2-chloroacetamide
Smiles: ClCC(=O)/N=C(/Nc1nc(C)c2c(n1)cccc2)\N

STK059996
Synonyms: N-{2-[piperidin-1-yl(thioxo)acetyl]phenyl}acetamide
Smiles: CC(=O)Nc1ccccc1C(=O)C(=S)N1CCCCC1

STK060013
Synonyms: (2Z)-2-({1-[2-(2,4-dimethylphenoxy)ethyl]-2-methyl-1H-indol-3-yl}methylidene)[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Smiles: Cc1ccc(c(c1)C)OCCn1c2ccccc2c(c1C)/C=c/1\sc2n(c1=O)c1c(n2)cccc1

STK060039
Synonyms: 5-chloro-8-[(2-fluorobenzyl)oxy]quinoline
Smiles: Fc1ccccc1COc1ccc(c2c1nccc2)Cl

STK060041
Synonyms: 4-benzyl-2-[(E)-{[2-(naphthalen-1-yl)-1,3-benzoxazol-5-yl]imino}methyl]phenol
Smiles: Oc1ccc(cc1/C=N/c1ccc2c(c1)nc(o2)c1cccc2c1cccc2)Cc1ccccc1

STK060064
Synonyms: 1-(3-chlorophenyl)-3-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(SCC(=O)N2CCCCC2)nc(c2c1CCCC2)c1cccc(c1)Cl

STK060069
Synonyms: 1-(5-{[(4-fluorobenzyl)sulfanyl]methyl}-1,3,4-thiadiazol-2-yl)-3-(4-methoxyphenyl)urea
Smiles: COc1ccc(cc1)NC(=O)Nc1nnc(s1)CSCc1ccc(cc1)F

STK060080
Synonyms: N-(2-chloro-6-fluorobenzyl)-2-(3,4-dimethoxyphenyl)-N-methylethanamine
Smiles: COc1ccc(cc1OC)CCN(Cc1c(F)cccc1Cl)C

STK060109
Synonyms: 2,8-dimethyl-3-(prop-2-en-1-yl)quinolin-4-ol
Smiles: C=CCc1c(C)nc2c(c1O)cccc2C

STK060111
Synonyms: (4Z)-4-[2-(2-methoxyphenyl)hydrazinylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-carbothioamide
Smiles: COc1ccccc1N/N=C\1/C(=NN(C1=O)C(=S)N)C

STK060112
Synonyms: 4-[(4E)-4-{[5-(4-bromophenyl)furan-2-yl]methylidene}-3-methyl-5-oxopyrazolidin-1-yl]benzoicacid
Smiles: Brc1ccc(cc1)c1ccc(o1)/C=C/1\C(C)NN(C1=O)c1ccc(cc1)C(=O)O

STK060122
Synonyms: 6-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-2-sulfanyl-1,4-dihydropyrimidin-4-ol
Smiles: OC1C=C(CSc2nc(C)cc(n2)C)NC(=N1)S

STK060130
Synonyms: 1,3-dimethyl-2-thioxo-5-[(tricyclo[3.3.1.1~3,7~]dec-1-ylamino)methylidene]dihydropyrimidine-4,6(1H,5H)-dione
Smiles: CN1C(=S)N(C)C(=O)C(=CNC23CC4CC(C3)CC(C2)C4)C1=O

STK060144
Synonyms: (5E)-3-(4-bromobenzyl)-5-(4-hydroxy-3-methoxy-5-nitrobenzylidene)imidazolidine-2,4-dione
Smiles: COc1cc(/C=C\2/NC(=O)N(C2=O)Cc2ccc(cc2)Br)cc(c1O)[N+](=O)[O-]

STK060171
Synonyms: 5-[1,1,1,3,3,3-hexafluoro-2-(2-phenyl-1,3-benzoxazol-6-yl)propan-2-yl]-2-phenyl-1,3-benzoxazole
Smiles: FC(C(C(F)(F)F)(c1ccc2c(c1)nc(o2)c1ccccc1)c1ccc2c(c1)oc(n2)c1ccccc1)(F)F

STK060175
Synonyms: 3-(4-chlorobenzyl)-4-[(2,5-dimethoxyphenyl)amino]-4-oxobutanoicacid
Smiles: COc1ccc(cc1NC(=O)C(Cc1ccc(cc1)Cl)CC(=O)O)OC

STK060184
Synonyms: 1-[(4-methoxyphenyl)sulfonyl]-1H-benzotriazole
Smiles: COc1ccc(cc1)S(=O)(=O)n1nnc2c1cccc2

STK060196
Synonyms: 1-(4-ethoxybenzyl)-N-(3-ethoxypropyl)piperidine-4-carboxamide
Smiles: CCOCCCNC(=O)C1CCN(CC1)Cc1ccc(cc1)OCC

STK060200
Synonyms: 3-(4-bromophenyl)-3-[(4-ethylphenyl)amino]-1-(4-fluorophenyl)propan-1-one
Smiles: CCc1ccc(cc1)NC(c1ccc(cc1)Br)CC(=O)c1ccc(cc1)F

STK060217
Synonyms: caesium(5R,7S)-3-hydroxytricyclo[3.3.1.1~3,7~]decane-1-carboxylate
Smiles: [Cs]OC(=O)C12C[C@@H]3C[C@H](C1)CC(C2)(C3)O

STK060223
Synonyms: 2-methyl-8-(methylsulfanyl)-6-phenyl-5H,6H-[1,3,4]thiadiazolo[2',3':2,3]pyrimido[4,5-d][1,3]thiazin-5-one
Smiles: CSC1=Nc2c(C(S1)c1ccccc1)c(=O)nc1n2nc(s1)C

STK060225
Synonyms: N-(5-methyl-4-oxo-4,5-dihydro-1,3-thiazol-2-yl)-10H-phenothiazine-10-carboxamide
Smiles: O=C1N=C(SC1C)NC(=O)N1c2ccccc2Sc2c1cccc2

STK060230
Synonyms: 2-[(4,6-dimethylquinazolin-2-yl)amino]-1-methylquinazolin-4(1H)-one
Smiles: Cc1ccc2c(c1)c(C)nc(n2)Nc1nc(=O)c2c(n1C)cccc2

STK060249
Synonyms: tert-butyl(2E)-2-[1-(1-hydroxynaphthalen-2-yl)ethylidene]hydrazinecarboxylate
Smiles: O=C(OC(C)(C)C)N/N=C(/c1ccc2c(c1O)cccc2)\C

STK060264
Synonyms: 2-chloro-N'-[(1E)-1-(6-methoxy-2-oxo-2H-chromen-3-yl)ethylidene]benzohydrazide
Smiles: COc1ccc2c(c1)cc(c(=O)o2)/C(=N/NC(=O)c1ccccc1Cl)/C

STK060273
Synonyms: 8-(methoxymethyl)-2,3,3a,4,5,6-hexahydro-1H-pyrazino[3,2,1-jk]carbazole
Smiles: COCc1ccc2c(c1)c1CCCC3c1n2CCN3

STK060298
Synonyms: 3-{[2-(2-methoxyphenyl)-1,3-dioxo-2,3-dihydro-1H-benzo[de]isoquinolin-6-yl]sulfonyl}benzoicacid
Smiles: COc1ccccc1n1c(=O)c2ccc(c3c2c(c1=O)ccc3)S(=O)(=O)c1cccc(c1)C(=O)O

STK060336
Synonyms: (5Z)-5-(3,5-dibromo-4-hydroxybenzylidene)-3-(2-fluorobenzyl)imidazolidine-2,4-dione
Smiles: O=C1N/C(=C\c2cc(Br)c(c(c2)Br)O)/C(=O)N1Cc1ccccc1F

STK060338
Synonyms: 1-(3,4-dimethylphenyl)-3-[5-(2-phenylethyl)-1,3,4-thiadiazol-2-yl]urea
Smiles: O=C(Nc1nnc(s1)CCc1ccccc1)Nc1ccc(c(c1)C)C

STK060356
Synonyms: 7-(2,4-dichlorobenzyl)-8-[(3-hydroxypropyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCCNc1nc2c(n1Cc1ccc(cc1Cl)Cl)c(=O)n(c(=O)n2C)C

STK060390
Synonyms: [4-(4-methoxyphenyl)-2-(3-nitrophenyl)-1,3-thiazol-5-yl]aceticacid
Smiles: COc1ccc(cc1)c1nc(sc1CC(=O)O)c1cccc(c1)[N+](=O)[O-]

STK060393
Synonyms: 2-(5-pentyl-1,2,4-oxadiazol-3-yl)pyridine
Smiles: CCCCCc1onc(n1)c1ccccn1

STK060401
Synonyms: N-(3-{[(2E)-3-(furan-2-yl)prop-2-enoyl]amino}phenyl)-2-methylbenzamide
Smiles: O=C(Nc1cccc(c1)NC(=O)c1ccccc1C)/C=C/c1ccco1

STK060425
Synonyms: 1-(1,3-benzodioxol-5-yl)-2-{[4-(4-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: Cc1ccc(cc1)n1c(SCC(=O)c2ccc3c(c2)OCO3)nnc1c1ccncc1

STK060465
Synonyms: N-(4-chlorobenzyl)-2-(4-methylphenoxy)acetamide
Smiles: O=C(COc1ccc(cc1)C)NCc1ccc(cc1)Cl

STK060476
Synonyms: 2-{4-[(2-chlorobenzyl)oxy]phenyl}-3-(4-ethylphenyl)-2,3-dihydroquinazolin-4(1H)-one
Smiles: CCc1ccc(cc1)N1C(Nc2c(C1=O)cccc2)c1ccc(cc1)OCc1ccccc1Cl

STK060496
Synonyms: 1-[1-(4-fluorophenyl)-2,5-dioxopyrrolidin-3-yl]-1-(4-methoxybenzyl)-3-methylthiourea
Smiles: CNC(=S)N(C1CC(=O)N(C1=O)c1ccc(cc1)F)Cc1ccc(cc1)OC

STK060529
Synonyms: 2-[(E)-2-phenylethenyl]-5-propylpyridine
Smiles: CCCc1ccc(nc1)/C=C/c1ccccc1

STK060554
Synonyms: N-[1-(2,4-dichlorophenyl)hexyl]formamide
Smiles: CCCCCC(c1ccc(cc1Cl)Cl)NC=O

STK060558
Synonyms: N,N'-bis(5-chloropyridin-2-yl)ethanediamide
Smiles: Clc1ccc(nc1)NC(=O)C(=O)Nc1ccc(cn1)Cl

STK060562
Synonyms: 2-chloro-N-[2-methoxy-4-({[(4-methylphenoxy)acetyl]carbamothioyl}amino)phenyl]benzamide
Smiles: COc1cc(ccc1NC(=O)c1ccccc1Cl)NC(=S)NC(=O)COc1ccc(cc1)C

STK060576
Synonyms: methyl4'-octylbiphenyl-4-carboximidoate
Smiles: CCCCCCCCc1ccc(cc1)c1ccc(cc1)C(=N)OC

STK060580
Synonyms: 1-[3-(tert-butylperoxy)-3-methylbut-1-yn-1-yl]cyclopentyloctanoate
Smiles: CCCCCCCC(=O)OC1(CCCC1)C#CC(OOC(C)(C)C)(C)C

STK060593
Synonyms: 4-[3-(2-chlorobenzyl)-1,2,4-oxadiazol-5-yl]benzonitrile
Smiles: N#Cc1ccc(cc1)c1onc(n1)Cc1ccccc1Cl

STK060602
Synonyms: 2,6,10-trimethyltripyrazolo[1,5-a:1',5'-c:1'',5''-e][1,3,5]triazine-3-sulfonicacid
Smiles: Cc1cc2n(n1)c1n(c3n2nc(c3)C)nc(c1S(=O)(=O)O)C

STK060607
Synonyms: 1-{1-(5-chlorothiophen-2-yl)-1-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]ethyl}piperidine
Smiles: Clc1ccc(s1)C(c1nnnn1c1c(C)cccc1C)(N1CCCCC1)C

STK060621
Synonyms: N-[(E)-{3-ethoxy-4-[(4-fluorobenzyl)oxy]phenyl}methylidene]-4H-1,2,4-triazol-3-amine
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)F)/C=N/c1[nH]cnn1

STK060628
Synonyms: [2-(3-cyanophenyl)hydrazinylidene]propanedinitrile
Smiles: N#Cc1cccc(c1)NN=C(C#N)C#N

STK060631
Synonyms: 2-(2-bromo-4-nitrophenoxy)-N'-{(E)-[4-(diethylamino)phenyl]methylidene}acetohydrazide
Smiles: CCN(c1ccc(cc1)/C=N/NC(=O)COc1ccc(cc1Br)[N+](=O)[O-])CC

STK060637
Synonyms: diamino{[(2R,4S)-2,6-dimethyl-1-(phenylcarbonyl)-1,2,3,4-tetrahydroquinolin-4-yl]sulfanyl}methylium
Smiles: N[C+](S[C@H]1C[C@@H](C)N(c2c1cc(C)cc2)C(=O)c1ccccc1)N

STK060662
Synonyms: ethyl4-(2-hydroxybenzyl)piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)Cc1ccccc1O

STK060663
Synonyms: 4-hydrazinyl-2-(methylsulfanyl)pyrimidine
Smiles: CSc1nccc(n1)NN

STK060676
Synonyms: N-(5-chloro-2-methoxyphenyl)-2,6-dimethoxybenzamide
Smiles: COc1ccc(cc1NC(=O)c1c(OC)cccc1OC)Cl

STK060738
Synonyms: ethyl2-amino-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-carboxylate
Smiles: CCOC(=O)c1cc2COC(Cc2nc1N)(C)C

STK060740
Synonyms: 3-chloro-4-methyl-N-(4H-1,2,4-triazol-3-yl)benzamide
Smiles: O=C(c1ccc(c(c1)Cl)C)Nc1nnc[nH]1

STK060748
Synonyms: methyl4-(dimethylamino)-3-[(4,4-dimethyl-3-oxopentanoyl)amino]benzoate
Smiles: COC(=O)c1ccc(c(c1)NC(=O)CC(=O)C(C)(C)C)N(C)C

STK060779
Synonyms: (3E)-N-[4-(acetylamino)phenyl]-3-{2-[oxo(pyrrolidin-1-yl)acetyl]hydrazinylidene}butanamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)C/C(=N/NC(=O)C(=O)N1CCCC1)/C

STK060794
Synonyms: N-(4,5-dihydro-1,3-thiazol-2-ylcarbamothioyl)-1-benzofuran-2-carboxamide
Smiles: S=C(NC(=O)c1cc2c(o1)cccc2)NC1=NCCS1

STK060815
Synonyms: 2-[(4-cyano-1-phenyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-N-(3,4-dichlorophenyl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(c(c2)Cl)Cl)nc(c2c1CCCC2)c1ccccc1

STK060839
Synonyms: 4-(1,3-dibenzylimidazolidin-2-yl)benzene-1,3-diol
Smiles: Oc1ccc(c(c1)O)C1N(CCN1Cc1ccccc1)Cc1ccccc1

STK060842
Synonyms: 2-(2-hydroxy-4-methylphenyl)-7-methyl-2,3,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one
Smiles: CN1CCc2c(C1)sc1c2C(=O)NC(N1)c1ccc(cc1O)C

STK060863
Synonyms: 1-azabicyclo[2.2.2]oct-3-yl4-fluorobenzoate
Smiles: O=C(c1ccc(cc1)F)OC1CN2CCC1CC2

STK060876
Synonyms: 5-phenyl-3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazole
Smiles: COc1cc(cc(c1OC)OC)c1noc(n1)c1ccccc1

STK060877
Synonyms: (E)-2-[1-(4-chlorobenzyl)-1H-benzimidazol-2-yl]-1-(3-fluorophenyl)ethenyl3-fluorobenzoate
Smiles: Clc1ccc(cc1)Cn1c(/C=C(\c2cccc(c2)F)/OC(=O)c2cccc(c2)F)nc2c1cccc2

STK060893
Synonyms: N-(1,3-dioxo-2-phenyl-2,3-dihydro-1H-isoindol-4-yl)-2-(thiophen-2-yl)acetamide
Smiles: O=C(Nc1cccc2c1C(=O)N(C2=O)c1ccccc1)Cc1cccs1

STK060904
Synonyms: 8-{[(6-chloro-1,3-benzodioxol-5-yl)methyl]sulfanyl}-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione
Smiles: Clc1cc2OCOc2cc1CSc1nc2c([nH]1)n(C)c(=O)n(c2=O)C

STK060934
Synonyms: N-heptylpyridine-4-carboxamide
Smiles: CCCCCCCNC(=O)c1ccncc1

STK060965
Synonyms: 3-(3,4-dimethoxybenzyl)-5-(4-ethylphenyl)-1,2,4-oxadiazole
Smiles: CCc1ccc(cc1)c1onc(n1)Cc1ccc(c(c1)OC)OC

STK060966
Synonyms: 6-oxo-2-{[2-oxo-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]sulfanyl}-4-(trifluoromethyl)-1,6-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(cc(=O)[nH]c1SCC(=O)C12CC3CC(C2)CC(C1)C3)C(F)(F)F

STK060997
Synonyms: 2-(2,5-dimethyl-1H-indol-3-yl)-N-(3-nitrophenyl)acetamide
Smiles: O=C(Cc1c(C)[nH]c2c1cc(C)cc2)Nc1cccc(c1)[N+](=O)[O-]

STK061001
Synonyms: N-(3-acetylphenyl)-1-benzyl-5-oxopyrrolidine-3-carboxamide
Smiles: O=C(C1CC(=O)N(C1)Cc1ccccc1)Nc1cccc(c1)C(=O)C

STK061005
Synonyms: N-{1-[(2E)-2-(4-chlorobenzylidene)hydrazinyl]-3-methyl-1-oxobutan-2-yl}benzenesulfonamide(non-preferredname)
Smiles: CC(C(C(=O)N/N=C/c1ccc(cc1)Cl)NS(=O)(=O)c1ccccc1)C

STK061019
Synonyms: 2-{[(2-chlorophenyl)carbonyl]amino}-6-methyl-N-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: CCCNC(=O)c1c(sc2c1CCC(C2)C)NC(=O)c1ccccc1Cl

STK061030
Synonyms: N-(3-chloro-2-methylphenyl)-4-methylbenzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)Nc1cccc(c1C)Cl

STK061043
Synonyms: 3b,6,6a,7,9,9a,10,12a-octahydrocyclopenta[c]cyclopenta[4,5]pyrido[3,2,1-ij]quinoline-2-carboxylicacid
Smiles: OC(=O)c1cc2C3C=CCC3CN3c2c(c1)C1C=CCC1C3

STK061044
Synonyms: 2-(2-bromo-4-nitrophenoxy)-N'-[(E)-(2,4-dihydroxy-6-methylphenyl)methylidene]acetohydrazide
Smiles: O=C(COc1ccc(cc1Br)[N+](=O)[O-])N/N=C/c1c(C)cc(cc1O)O

STK061056
Synonyms: N'-[(1E)-1-(2,4,6-trimethylpyridin-3-yl)ethylidene]benzohydrazide
Smiles: Cc1cc(C)c(c(n1)C)/C(=N/NC(=O)c1ccccc1)/C

STK061068
Synonyms: 4-hydroxy-1-methyl-2-oxo-N'-pentanoyl-1,2-dihydroquinoline-3-carbohydrazide
Smiles: CCCCC(=O)NNC(=O)c1c(O)c2ccccc2n(c1=O)C

STK061075
Synonyms: (6Z)-6-{3-bromo-4-[2-(2,5-dimethylphenoxy)ethoxy]-5-ethoxybenzylidene}-5-imino-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Smiles: CCOc1cc(cc(c1OCCOc1cc(C)ccc1C)Br)/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1

STK061094
Synonyms: 3-[2-amino-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]propanoicacid
Smiles: COc1ccc(cc1)c1nc(sc1CCC(=O)O)N

STK061107
Synonyms: 8,8-dimethyl-3-(piperidin-1-ylcarbonyl)-1,2,3,4,5,6,7,8-octahydronaphthalene-2-carboxylicacid
Smiles: O=C(C1CC2=C(CC1C(=O)O)C(CCC2)(C)C)N1CCCCC1

STK061114
Synonyms: (2Z)-2-[4-(dimethylamino)benzylidene]-4-hydroxy-3-(phenylcarbonyl)naphthalen-1(2H)-one
Smiles: CN(c1ccc(cc1)/C=C\1/C(=C(O)c2c(C1=O)cccc2)C(=O)c1ccccc1)C

STK061136
Synonyms: 4-(5-{(Z)-[5-cyano-1-(3-hydroxypropyl)-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene]methyl}furan-2-yl)benzenesulfonamide
Smiles: OCCCN1C(=O)/C(=C\c2ccc(o2)c2ccc(cc2)S(=O)(=O)N)/C(=C(C1=O)C#N)C

STK061148
Synonyms: ethyl4-methyl-2-({[(3,4,5-triethoxyphenyl)carbonyl]carbamothioyl}amino)-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(nc1C)NC(=S)NC(=O)c1cc(OCC)c(c(c1)OCC)OCC

STK061152
Synonyms: (3Z,3'Z)-3,3'-(1Z,2Z)-hydrazine-1,2-diylidenebis(6-bromo-5-methyl-1,3-dihydro-2H-indol-2-one)
Smiles: O=C1Nc2c(/C/1=N/N=C/1\C(=O)Nc3c1cc(C)c(c3)Br)cc(c(c2)Br)C

STK061192
Synonyms: N-(3-{[(3-bromo-4-methoxyphenyl)carbonyl]amino}phenyl)thiophene-2-carboxamide
Smiles: COc1ccc(cc1Br)C(=O)Nc1cccc(c1)NC(=O)c1cccs1

STK061228
Synonyms: N-(4-hydroxyphenyl)-4-(4-nitrophenoxy)benzamide
Smiles: Oc1ccc(cc1)NC(=O)c1ccc(cc1)Oc1ccc(cc1)[N+](=O)[O-]

STK061230
Synonyms: [(3,5-dichlorophenyl)amino](phenylsulfonyl)methanone
Smiles: Clc1cc(cc(c1)Cl)NC(=O)S(=O)(=O)c1ccccc1

STK061245
Synonyms: N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-methyl-3-nitrobenzamide
Smiles: O=C(c1cccc(c1C)[N+](=O)[O-])Nc1ccc(cc1)c1nc2c(o1)cccc2

STK061264
Synonyms: pyridin-3-yl3-methoxybenzoate
Smiles: COc1cccc(c1)C(=O)Oc1cccnc1

STK061272
Synonyms: 6-ethoxy-3-(4-methoxybenzyl)-2-methylquinolin-4-ol
Smiles: CCOc1ccc2c(c1)c(O)c(c(n2)C)Cc1ccc(cc1)OC

STK061275
Synonyms: (2Z)-3-(3-bromophenyl)-2-(2-oxopyridin-1(2H)-yl)-N,N-di(prop-2-en-1-yl)prop-2-enamide
Smiles: C=CCN(C(=O)/C(=C/c1cccc(c1)Br)/n1ccccc1=O)CC=C

STK061284
Synonyms: 1-[(2,4-dimethoxyphenyl)(morpholin-4-yl)methyl]naphthalen-2-ol
Smiles: COc1cc(OC)ccc1C(c1c(O)ccc2c1cccc2)N1CCOCC1

STK061287
Synonyms: 3-{(2E)-2-[(3E)-4-(furan-2-yl)but-3-en-2-ylidene]hydrazinyl}benzoicacid
Smiles: C/C(=N\Nc1cccc(c1)C(=O)O)/C=C/c1ccco1

STK061297
Synonyms: 6,8-dichloro-2-oxo-N-(1,3-thiazol-2-yl)-2H-chromene-3-carboxamide
Smiles: Clc1cc(Cl)c2c(c1)cc(c(=O)o2)C(=O)Nc1nccs1

STK061298
Synonyms: 1-[5-tert-butyl-5-hydroxy-3-(pentafluoroethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(2,4-dichlorophenoxy)ethanone
Smiles: Clc1ccc(c(c1)Cl)OCC(=O)N1N=C(CC1(O)C(C)(C)C)C(C(F)(F)F)(F)F

STK061299
Synonyms: N-(3-acetylphenyl)-1H-1,2,4-triazole-3-carboxamide
Smiles: O=C(c1n[nH]cn1)Nc1cccc(c1)C(=O)C

STK061310
Synonyms: 2-(naphthalen-1-yloxy)-N-(pyridin-3-yl)acetamide
Smiles: O=C(Nc1cccnc1)COc1cccc2c1cccc2

STK061314
Synonyms: 2-(4-chlorophenyl)-5-[4-(4-pentylphenyl)cyclohexyl]-1,3,4-thiadiazole
Smiles: CCCCCc1ccc(cc1)C1CCC(CC1)c1nnc(s1)c1ccc(cc1)Cl

STK061329
Synonyms: 2-(3-methyl-1H-1,2,4-triazol-5-yl)propan-2-ol
Smiles: Cc1n[nH]c(n1)C(O)(C)C

STK061349
Synonyms: (2E)-4-({4-[(4-methoxyphenyl)sulfamoyl]phenyl}amino)-4-oxobut-2-enoicacid
Smiles: COc1ccc(cc1)NS(=O)(=O)c1ccc(cc1)NC(=O)/C=C/C(=O)O

STK061381
Synonyms: N-[(E)-1H-indol-3-ylmethylidene]-4-[(E)-phenyldiazenyl]aniline
Smiles: c1ccc(cc1)/N=N/c1ccc(cc1)/N=C/c1c[nH]c2c1cccc2

STK061399
Synonyms: methyl2-amino-4-{2-[(4-chlorobenzyl)oxy]phenyl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Smiles: COC(=O)C1=C(N)OC2=C(C1c1ccccc1OCc1ccc(cc1)Cl)C(=O)CC(C2)(C)C

STK061404
Synonyms: methyl(2E)-4-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxobut-2-enoate
Smiles: COC(=O)/C=C/C(=O)Nc1sc2c(c1C#N)CCCC2

STK061413
Synonyms: N-{[(2-oxo-2H-chromen-7-yl)oxy]acetyl}glycine
Smiles: O=C(COc1ccc2c(c1)oc(=O)cc2)NCC(=O)O

STK061417
Synonyms: diethyl2,2'-[(2-oxo-4-phenyl-2H-chromene-5,7-diyl)bis(oxy)]dipropanoate
Smiles: CCOC(=O)C(Oc1cc(OC(C(=O)OCC)C)c2c(c1)oc(=O)cc2c1ccccc1)C

STK061418
Synonyms: (5E)-5-{3-bromo-4-[(2,4-dichlorobenzyl)oxy]-5-ethoxybenzylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCOc1cc(/C=C\2/SC(=S)N(C2=O)CC)cc(c1OCc1ccc(cc1Cl)Cl)Br

STK061453
Synonyms: (4Z)-2-(1,3-benzothiazol-2-yl)-4-{1-[(2-methoxyethyl)amino]ethylidene}-5-{[(4-methylphenyl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one
Smiles: COCCN/C(=C\1/C(=NN(C1=O)c1nc2c(s1)cccc2)CSc1ccc(cc1)C)/C

STK061458
Synonyms: 4-hydroxy-N'-(3-methylbutanoyl)-2-oxo-1,2-dihydroquinoline-3-carbohydrazide
Smiles: CC(CC(=O)NNC(=O)c1c(=O)[nH]c2c(c1O)cccc2)C

STK061463
Synonyms: methyl2-{[(E)-1,3-benzodioxol-5-ylmethylidene]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(/N=C/c2ccc3c(c2)OCO3)sc2c1CCC2

STK061495
Synonyms: N-[3-(morpholin-4-yl)propyl]-4-oxo-4-{2-[(5-phenylfuran-2-yl)carbonyl]hydrazinyl}butanamide
Smiles: O=C(NNC(=O)c1ccc(o1)c1ccccc1)CCC(=O)NCCCN1CCOCC1

STK061496
Synonyms: (6Z)-6-{3-[2-(3,5-dimethylphenoxy)ethoxy]benzylidene}-5-imino-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Smiles: Cc1cc(OCCOc2cccc(c2)/C=C/2\C(=O)N=c3n(C2=N)c(cs3)c2ccccc2)cc(c1)C

STK061497
Synonyms: ethyl(4E)-3-methyl-4-[2-(4-nitrophenyl)hydrazinylidene]-4,5,6,7-tetrahydro-1-benzofuran-2-carboxylate
Smiles: CCOC(=O)c1oc2c(c1C)/C(=N/Nc1ccc(cc1)[N+](=O)[O-])/CCC2

STK061539
Synonyms: (5Z)-5-[(2Z)-3-bromo-3-phenylprop-2-en-1-ylidene]-3-ethyl-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCN1C(=S)S/C(=C\C=C(\c2ccccc2)/Br)/C1=O

STK061642
Synonyms: 1-(3,4-dichlorophenyl)-2-[2-(morpholin-4-yl)-1H-benzimidazol-1-yl]ethanone
Smiles: O=C(c1ccc(c(c1)Cl)Cl)Cn1c(nc2c1cccc2)N1CCOCC1

STK061689
Synonyms: (2Z,3E)-3-[2-(furan-2-ylcarbonyl)hydrazinylidene]-2-(hydroxyimino)-N-phenylbutanamide
Smiles: O/N=C(\C(=O)Nc1ccccc1)/C(=N/NC(=O)c1ccco1)/C

STK061694
Synonyms: 4-(5-{(Z)-[(2Z)-3-cyclohexyl-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoicacid
Smiles: OC(=O)c1ccc(cc1)c1ccc(o1)/C=C/1\S/C(=N\c2ccccc2)/N(C1=O)C1CCCCC1

STK061697
Synonyms: methyl4-[(1S,2S,3aR)-3,3-dicyano-1-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-2-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)[C@@H]1[C@H](N2[C@@H](C1(C#N)C#N)C=Cc1c2cccc1)C(=O)C12CC3CC(C2)CC(C1)C3

STK061711
Synonyms: 5,5'-[(4-nitrophenyl)methanediyl]dipyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)C(C(=O)N1)C(C1C(=O)NC(=O)NC1=O)c1ccc(cc1)[N+](=O)[O-]

STK061728
Synonyms: 2-(4-bromo-3-chlorophenyl)-5-nitro-1H-isoindole-1,3(2H)-dione
Smiles: O=C1c2cc(ccc2C(=O)N1c1ccc(c(c1)Cl)Br)[N+](=O)[O-]

STK061756
Synonyms: [4-(4-phenoxyphenyl)-2-phenyl-1,3-thiazol-5-yl]aceticacid
Smiles: OC(=O)Cc1sc(nc1c1ccc(cc1)Oc1ccccc1)c1ccccc1

STK061765
Synonyms: (2E)-2-cyano-N-(furan-2-ylmethyl)-3-(1-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}-1H-pyrrol-2-yl)prop-2-enamide
Smiles: N#C/C(=C\c1cccn1CCOc1cc(C)ccc1C(C)C)/C(=O)NCc1ccco1

STK061774
Synonyms: (2E)-3-(3-{[(E)-(4-fluorophenyl)methylidene]amino}phenyl)prop-2-enoicacid
Smiles: OC(=O)/C=C/c1cccc(c1)/N=C/c1ccc(cc1)F

STK061808
Synonyms: 2-[(7-methoxy-4-methylquinazolin-2-yl)amino]-5,6-dimethylpyrimidin-4(1H)-one
Smiles: COc1ccc2c(c1)nc(nc2C)Nc1nc(=O)c(c([nH]1)C)C

STK061809
Synonyms: N-[(4-{[(4-bromophenyl)sulfonyl]amino}phenyl)sulfonyl]acetamide
Smiles: CC(=O)NS(=O)(=O)c1ccc(cc1)NS(=O)(=O)c1ccc(cc1)Br

STK061821
Synonyms: 2-(4-methylbenzyl)-1,2,3,4-tetrahydroisoquinoline
Smiles: Cc1ccc(cc1)CN1CCc2c(C1)cccc2

STK061822
Synonyms: N-benzyl-6-(piperidin-1-yl)-1,3,5-triazine-2,4-diamine
Smiles: Nc1nc(NCc2ccccc2)nc(n1)N1CCCCC1

STK061840
Synonyms: N-(4-hydroxy-2-oxo-1,2-dihydroquinolin-3-yl)tridecanamide
Smiles: CCCCCCCCCCCCC(=O)Nc1c(=O)[nH]c2c(c1O)cccc2

STK061845
Synonyms: 4-chloro-N-(4-methoxybenzyl)benzenesulfonamide
Smiles: COc1ccc(cc1)CNS(=O)(=O)c1ccc(cc1)Cl

STK061849
Synonyms: 3,4-dimethyl-N-(4-methylpyridin-2-yl)benzamide
Smiles: Cc1ccnc(c1)NC(=O)c1ccc(c(c1)C)C

STK061855
Synonyms: N-[1-(2-chlorophenyl)-2-cyano-1H-benzo[f]chromen-3-yl]acetamide
Smiles: N#CC1=C(NC(=O)C)Oc2c(C1c1ccccc1Cl)c1ccccc1cc2

STK061873
Synonyms: 2-{[(1-benzofuran-2-ylcarbonyl)carbamothioyl]amino}benzoicacid
Smiles: S=C(Nc1ccccc1C(=O)O)NC(=O)c1cc2c(o1)cccc2

STK061884
Synonyms: 2-(naphthalen-1-ylamino)-N'-{(E)-[5-(4-nitrophenyl)furan-2-yl]methylidene}acetohydrazide(non-preferredname)
Smiles: O=C(CNc1cccc2c1cccc2)N/N=C/c1ccc(o1)c1ccc(cc1)[N+](=O)[O-]

STK061885
Synonyms: 3-(2,6-difluorophenyl)-5-(4-methoxyphenyl)-1,2,4-oxadiazole
Smiles: COc1ccc(cc1)c1onc(n1)c1c(F)cccc1F

STK061893
Synonyms: 2-{4-methoxy-3-[(2-methyl-4-nitrophenoxy)methyl]phenyl}-1,3-thiazolidine-4-carboxylicacid
Smiles: COc1ccc(cc1COc1ccc(cc1C)[N+](=O)[O-])C1SCC(N1)C(=O)O

STK061914
Synonyms: 5-(3-bromo-5-chloro-4-hydroxybenzylidene)-1,3-dimethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CN1C(=S)N(C)C(=O)C(=Cc2cc(Cl)c(c(c2)Br)O)C1=O

STK061924
Synonyms: N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]-3-methylbenzamide
Smiles: S=C(Nc1cc(ccc1O)C(C)(C)C)NC(=O)c1cccc(c1)C

STK061961
Synonyms: 7-methyl-2-[(2-methylprop-2-en-1-yl)sulfanyl]-3-phenyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CC(=C)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCN(C3)C

STK061972
Synonyms: 4,4'-sulfonylbis(2-{[(E)-pyridin-3-ylmethylidene]amino}phenol)
Smiles: Oc1ccc(cc1/N=C/c1cccnc1)S(=O)(=O)c1ccc(c(c1)/N=C/c1cccnc1)O

STK061977
Synonyms: N-(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-1H-1,2,4-triazole-3-carboxamide
Smiles: O=C(c1n[nH]cn1)Nc1ccc2c(c1)[nH]c(=O)[nH]2

STK061981
Synonyms: 3'-methylbiphenyl-3-carboxylicacid
Smiles: Cc1cccc(c1)c1cccc(c1)C(=O)O

STK061995
Synonyms: ethyl{[4-cyano-1-(piperidin-1-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc(N2CCCCC2)c2c(c1C#N)CCCC2

STK062002
Synonyms: 1-({[(E)-(4-bromophenyl)methylidene]amino}oxy)-3-phenylpropan-1-one
Smiles: O=C(CCc1ccccc1)O/N=C/c1ccc(cc1)Br

STK062003
Synonyms: 2-(1-methylhydrazinyl)-4,6-di(piperidin-1-yl)-1,3,5-triazine
Smiles: CN(c1nc(nc(n1)N1CCCCC1)N1CCCCC1)N

STK062035
Synonyms: 2-{[(E)-furan-2-ylmethylidene]amino}-4,5-dimethoxybenzoicacid
Smiles: COc1cc(/N=C/c2ccco2)c(cc1OC)C(=O)O

STK062046
Synonyms: N-(2,3-dimethylcyclohexyl)-4-hydrazinyl-4-oxobutanamide
Smiles: CC1C(CCCC1C)NC(=O)CCC(=O)NN

STK062062
Synonyms: ethyl1-[(4-nitrophenyl)sulfonyl]piperidine-3-carboxylate
Smiles: CCOC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-]

STK062072
Synonyms: N'-(cyclohexylcarbonyl)-4-phenylcyclohexanecarbohydrazide
Smiles: O=C(C1CCC(CC1)c1ccccc1)NNC(=O)C1CCCCC1

STK062135
Synonyms: 3-methyl-2-thioxo-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
Smiles: Cn1c(=S)[nH]c2c(c1=O)c1CCCCc1s2

STK062141
Synonyms: 4-{[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino}phenol
Smiles: Oc1ccc(cc1)Nc1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK062169
Synonyms: 6-(4-chlorophenyl)-5-(3-methylphenyl)-1-phenyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Smiles: Clc1ccc(cc1)c1nc2n(ncc2c(=O)n1c1cccc(c1)C)c1ccccc1

STK062178
Synonyms: (2Z)-3-amino-4,4,4-trichloro-1-(2-hydroxy-4-methylphenyl)but-2-en-1-one
Smiles: Cc1ccc(c(c1)O)C(=O)/C=C(/C(Cl)(Cl)Cl)\N

STK062185
Synonyms: 1-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4-phenyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Brc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCCC3

STK062201
Synonyms: (6Z)-6-(2-hydroxy-5-nitrobenzylidene)-5-imino-2-phenyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: O=C1N=c2sc(nn2C(=N)/C/1=C/c1cc(ccc1O)[N+](=O)[O-])c1ccccc1

STK062210
Synonyms: N-(2,3-dichlorophenyl)-2-oxo-2-[(2E)-2-(thiophen-2-ylmethylidene)hydrazinyl]acetamide
Smiles: O=C(C(=O)N/N=C/c1cccs1)Nc1cccc(c1Cl)Cl

STK062227
Synonyms: 1-[3-(benzyloxy)benzyl]-N-butylpiperidine-4-carboxamide
Smiles: CCCCNC(=O)C1CCN(CC1)Cc1cccc(c1)OCc1ccccc1

STK062233
Synonyms: 5-(3-methylphenyl)-3-[4-(4-pentylcyclohexyl)phenyl]-1,2,4-oxadiazole
Smiles: CCCCCC1CCC(CC1)c1ccc(cc1)c1noc(n1)c1cccc(c1)C

STK062243
Synonyms: (2E)-2-cyano-N-cyclohexyl-3-[2-(naphthalen-1-ylmethoxy)phenyl]prop-2-enamide
Smiles: N#C/C(=C\c1ccccc1OCc1cccc2c1cccc2)/C(=O)NC1CCCCC1

STK062253
Synonyms: 4-{5-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-1,2,4-oxadiazol-3-yl}-1,2,5-oxadiazol-3-amine
Smiles: Cc1onc(c1c1onc(n1)c1nonc1N)c1ccccc1Cl

STK062273
Synonyms: 2-[(E)-{[4,6-bis(4-{[(E)-(2-hydroxy-5-nitrophenyl)methylidene]amino}phenyl)pyrimidin-2-yl]imino}methyl]-4-nitrophenol
Smiles: Oc1ccc(cc1/C=N/c1nc(cc(n1)c1ccc(cc1)/N=C/c1cc(ccc1O)[N+](=O)[O-])c1ccc(cc1)/N=C/c1cc(ccc1O)[N+](=O)[O-])[N+](=O)[O-]

STK062288
Synonyms: 2-({5-[(2-chlorophenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,3-dichlorophenyl)acetamide
Smiles: O=C(Nc1cccc(c1Cl)Cl)CSc1nnc(n1C)COc1ccccc1Cl

STK062304
Synonyms: 5-bromo-N-{4-[5-(4-chlorophenyl)-1,2,4-oxadiazol-3-yl]phenyl}furan-2-carboxamide
Smiles: Clc1ccc(cc1)c1onc(n1)c1ccc(cc1)NC(=O)c1ccc(o1)Br

STK062329
Synonyms: 4-[(6'-methoxycinchonan-9-yl)oxy]-4-oxobutanoicacid
Smiles: C=CC1CN2CCC1CC2C(c1ccnc2c1cc(OC)cc2)OC(=O)CCC(=O)O

STK062341
Synonyms: 2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-3-[(2,2,6,6-tetramethylpiperidin-4-ylidene)amino]quinazolin-4(3H)-one
Smiles: Cc1ccc(c(c1)OCc1nc2ccccc2c(=O)n1N=C1CC(C)(C)NC(C1)(C)C)C(C)C

STK062345
Synonyms: sodium3-methyl-2-(2-methylpropyl)-5-oxo-5-[(1-phenyl-1H-pyrazol-3-yl)amino]pentanoate
Smiles: [Na]OC(=O)C(C(CC(=O)Nc1ccn(n1)c1ccccc1)C)CC(C)C

STK062351
Synonyms: (2Z)-3-{3-chloro-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxyphenyl}-2-(3,4-dimethoxyphenyl)prop-2-enenitrile
Smiles: COc1cc(/C=C(/c2ccc(c(c2)OC)OC)\C#N)cc(c1OCCOc1ccc(c(c1)C)C)Cl

STK062358
Synonyms: (2Z,5Z)-5-[(4-methoxynaphthalen-1-yl)methylidene]-2-[(4-methylphenyl)imino]-3-(2-phenylethyl)-1,3-thiazolidin-4-one
Smiles: COc1ccc(c2c1cccc2)/C=C/1\S/C(=N\c2ccc(cc2)C)/N(C1=O)CCc1ccccc1

STK062368
Synonyms: 1-(3-ethoxy-2-hydroxybenzyl)-N-(1-methoxypropan-2-yl)piperidine-4-carboxamide
Smiles: COCC(NC(=O)C1CCN(CC1)Cc1cccc(c1O)OCC)C

STK062373
Synonyms: (3-butyl-2-phenyl-1,3-oxazol-3-ium-5-yl)(trifluoroacetyl)azanide
Smiles: CCCC[n+]1cc(oc1c1ccccc1)[N-]C(=O)C(F)(F)F

STK062396
Synonyms: 7,11-bis(2,4-dichlorophenyl)-2,4,8,10-tetraazaspiro[5.5]undecane-1,3,5,9-tetrone
Smiles: O=C1NC(c2ccc(cc2Cl)Cl)C2(C(N1)c1ccc(cc1Cl)Cl)C(=O)NC(=O)NC2=O

STK062397
Synonyms: N'-[(1E)-1-(4-ethoxy-3-nitrophenyl)ethylidene]-1-methylbicyclo[4.1.0]heptane-7-carbohydrazide
Smiles: CCOc1ccc(cc1[N+](=O)[O-])/C(=N/NC(=O)C1C2C1(C)CCCC2)/C

STK062414
Synonyms: N-{(2Z)-8-methoxy-3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2H-chromen-2-ylidene}-1,3-thiazol-2-amine
Smiles: COc1ccc(cc1)c1csc(n1)c1cc2cccc(c2o/c/1=N\c1nccs1)OC

STK062415
Synonyms: 4-chloro-N-[2-hydroxy-3-(4-methoxyphenoxy)propyl]benzamide
Smiles: COc1ccc(cc1)OCC(CNC(=O)c1ccc(cc1)Cl)O

STK062426
Synonyms: 1-(cyclohexylmethyl)-N-(propan-2-yl)piperidine-4-carboxamide
Smiles: CC(NC(=O)C1CCN(CC1)CC1CCCCC1)C

STK062427
Synonyms: N,N-dibutyl-2-(4-hydroxy-2-oxo-1,2-dihydroquinolin-3-yl)acetamide
Smiles: CCCCN(C(=O)Cc1c(=O)[nH]c2c(c1O)cccc2)CCCC

STK062428
Synonyms: chloro[3-(formyloxy)-2,3-diphenylpropyl]mercury
Smiles: Cl[Hg]CC(C(c1ccccc1)OC=O)c1ccccc1

STK062435
Synonyms: 5-bromo-N-[2-chloro-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]naphthalene-1-carboxamide
Smiles: Clc1ccc(cc1NC(=O)c1cccc2c1cccc2Br)c1nc2c(o1)cccn2

STK062437
Synonyms: 9,10-dioxo-9,10-dihydroanthracene-1,8-diylbis[4-(4-pentylcyclohexyl)benzoate]
Smiles: CCCCCC1CCC(CC1)c1ccc(cc1)C(=O)Oc1cccc2c1C(=O)c1c(C2=O)cccc1OC(=O)c1ccc(cc1)C1CCC(CC1)CCCCC

STK062438
Synonyms: N-benzyl-N-(pyridin-2-ylmethyl)ethanamine
Smiles: CCN(Cc1ccccn1)Cc1ccccc1

STK062463
Synonyms: N-{[2-(3-chloro-4-ethoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]carbamothioyl}thiophene-2-carboxamide
Smiles: CCOc1ccc(cc1Cl)n1nc2c(n1)cc(c(c2)C)NC(=S)NC(=O)c1cccs1

STK062476
Synonyms: 1-(2,4-dimethoxybenzyl)-N-[3-(dimethylamino)-2,2-dimethylpropyl]piperidine-4-carboxamide
Smiles: COc1cc(OC)ccc1CN1CCC(CC1)C(=O)NCC(CN(C)C)(C)C

STK062494
Synonyms: 4-{(Z)-[(2Z)-4-oxo-2-(phenylimino)-3-propyl-1,3-thiazolidin-5-ylidene]methyl}benzoicacid
Smiles: CCCN1/C(=N/c2ccccc2)/S/C(=C\c2ccc(cc2)C(=O)O)/C1=O

STK062501
Synonyms: N-(4-methylpyridin-2-yl)-3-nitrobenzamide
Smiles: Cc1ccnc(c1)NC(=O)c1cccc(c1)[N+](=O)[O-]

STK062515
Synonyms: (4Z)-4-(anthracen-9-ylmethylidene)-3-(4-chlorophenyl)-1,2-oxazol-5(4H)-one
Smiles: Clc1ccc(cc1)C1=NOC(=O)/C/1=C\c1c2ccccc2cc2c1cccc2

STK062559
Synonyms: 2-[(2-methylphenyl)amino]-4,6-diphenylpyridine-3-carbonitrile
Smiles: N#Cc1c(nc(cc1c1ccccc1)c1ccccc1)Nc1ccccc1C

STK062561
Synonyms: (2Z)-2-[(2E)-(4-iodobenzylidene)hydrazinylidene]-3-methyl-2,3-dihydro-1,3-benzothiazole
Smiles: Ic1ccc(cc1)/C=N/N=c/1\sc2c(n1C)cccc2

STK062576
Synonyms: (6Z)-6-{4-[2-(4-chloro-3-methylphenoxy)ethoxy]-3-ethoxybenzylidene}-5-imino-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Smiles: CCOc1cc(ccc1OCCOc1ccc(c(c1)C)Cl)/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1

STK062586
Synonyms: (2E)-3-[(2,5-dichlorophenyl)amino]-1-phenylbut-2-en-1-one
Smiles: C/C(=C\C(=O)c1ccccc1)/Nc1cc(Cl)ccc1Cl

STK062634
Synonyms: N-[3-(dimethylamino)-2,2-dimethylpropyl]-1-[3-oxo-2-(2-oxopyridin-1(2H)-yl)-3-phenylpropanoyl]piperidine-4-carboxamide
Smiles: CN(CC(CNC(=O)C1CCN(CC1)C(=O)C(n1ccccc1=O)C(=O)c1ccccc1)(C)C)C

STK062651
Synonyms: N-{(2Z)-3-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-2H-chromen-2-ylidene}-1,3-thiazol-2-amine
Smiles: Clc1ccc(cc1Cl)c1csc(n1)c1cc2ccccc2o/c/1=N\c1nccs1

STK062661
Synonyms: N-{1-[(2,6-dimethylphenyl)carbamoyl]cyclohexyl}-N-(furan-2-ylmethyl)pyridine-2-carboxamide
Smiles: O=C(N(C1(CCCCC1)C(=O)Nc1c(C)cccc1C)Cc1ccco1)c1ccccn1

STK062689
Synonyms: 2-(1,3-benzoxazol-2-ylamino)-6-phenyl-5,6-dihydropyrimidin-4(1H)-one
Smiles: O=C1N=C(Nc2nc3c(o2)cccc3)NC(C1)c1ccccc1

STK062716
Synonyms: 4-[1-(hydroxymethyl)-1H-indol-3-yl]-4-oxobutanoicacid
Smiles: OCn1cc(c2c1cccc2)C(=O)CCC(=O)O

STK062722
Synonyms: [(ethylamino)methyl]phosphonicacid
Smiles: CCNCP(=O)(O)O

STK062737
Synonyms: 5-(propan-2-yl)pyridine-2-carboxylicacid
Smiles: CC(c1ccc(nc1)C(=O)O)C

STK062739
Synonyms: (5E)-3-benzyl-5-{4-[3-(4-tert-butylphenoxy)propoxy]-3-chloro-5-ethoxybenzylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCOc1cc(/C=C\2/SC(=S)N(C2=O)Cc2ccccc2)cc(c1OCCCOc1ccc(cc1)C(C)(C)C)Cl

STK062767
Synonyms: 2-(4-hydroxyphenyl)-5-(4-oxo-4H-3,1-benzoxazin-2-yl)-1H-isoindole-1,3(2H)-dione
Smiles: Oc1ccc(cc1)N1C(=O)c2c(C1=O)cc(cc2)c1nc2ccccc2c(=O)o1

STK062771
Synonyms: 6-(naphthalen-2-ylcarbamoyl)cyclohex-3-ene-1-carboxylicacid
Smiles: O=C(C1CC=CCC1C(=O)O)Nc1ccc2c(c1)cccc2

STK062780
Synonyms: 1,1'-benzene-1,2-diyldipyrrolidine-2,5-dione
Smiles: O=C1CCC(=O)N1c1ccccc1N1C(=O)CCC1=O

STK062784
Synonyms: 2-[(4,6-dimethylpyrimidin-2-yl)oxy]-3,3-bis(4-fluorophenyl)-3-propoxypropanoicacid
Smiles: CCCOC(C(C(=O)O)Oc1nc(C)cc(n1)C)(c1ccc(cc1)F)c1ccc(cc1)F

STK062802
Synonyms: methyl3-(1-acetyl-1H-indol-3-yl)-3-(acetylsulfanyl)-2-nitropropanoate
Smiles: COC(=O)C(C(c1cn(c2c1cccc2)C(=O)C)SC(=O)C)[N+](=O)[O-]

STK062809
Synonyms: N-(6-hydroxy-6-methylheptan-2-yl)-1-[(2E)-3-phenylprop-2-en-1-yl]piperidine-4-carboxamide
Smiles: CC(NC(=O)C1CCN(CC1)C/C=C/c1ccccc1)CCCC(O)(C)C

STK062813
Synonyms: 3-bromo-4-methoxy-N-{[2-(phenylcarbamothioyl)hydrazinyl]carbonothioyl}benzamide
Smiles: COc1ccc(cc1Br)C(=O)NC(=S)NNC(=S)Nc1ccccc1

STK062818
Synonyms: 6-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-1,3-dimethyl-5-nitropyrimidine-2,4(1H,3H)-dione
Smiles: COc1ccc(cc1OC)/C=C/c1n(C)c(=O)n(c(=O)c1[N+](=O)[O-])C

STK062836
Synonyms: N-[2-(dimethylamino)ethyl]-3-(thiophen-2-yl)benzamide
Smiles: CN(CCNC(=O)c1cccc(c1)c1cccs1)C

STK062838
Synonyms: {1-[4-(benzyloxy)-3-methoxybenzyl]piperidin-4-yl}(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)methanone
Smiles: COc1cc(ccc1OCc1ccccc1)CN1CCC(CC1)C(=O)N1CC2(CC1CC(C2)(C)C)C

STK062869
Synonyms: N-(1-heptyl-1H-benzimidazol-2-yl)acetamide
Smiles: CCCCCCCn1c(NC(=O)C)nc2c1cccc2

STK062872
Synonyms: (4-{(E)-[(2,4-dichlorophenyl)imino]methyl}-5-hydroxy-6-methylpyridin-3-yl)methyldihydrogenphosphate
Smiles: Clc1ccc(c(c1)Cl)/N=C/c1c(cnc(c1O)C)COP(=O)(O)O

STK062874
Synonyms: N'-[(E)-(3-ethoxy-4-hydroxyphenyl)methylidene]-4-hydroxy-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2c(O)c3ccccc3n(c2=O)C)ccc1O

STK062875
Synonyms: 5-(2-chloroethoxy)-1-[2-(4-chloro-2-fluoro-5-hydroxyphenyl)propan-2-yl]-3,4-dimethyl-1,5-dihydro-2H-pyrrol-2-one
Smiles: ClCCOC1C(=C(C(=O)N1C(c1cc(O)c(cc1F)Cl)(C)C)C)C

STK062884
Synonyms: 2-(4-chloro-3-methylphenoxy)-N'-[(1E)-1-(1-hydroxynaphthalen-2-yl)ethylidene]acetohydrazide
Smiles: O=C(COc1ccc(c(c1)C)Cl)N/N=C(/c1ccc2c(c1O)cccc2)\C

STK062889
Synonyms: ethyl(2Z)-(hydroxyimino)(1H-indol-3-yl)ethanoate
Smiles: CCOC(=O)/C(=N\O)/c1c[nH]c2c1cccc2

STK062890
Synonyms: 3-chloro-N-(3-methylpyridin-2-yl)benzamide
Smiles: Clc1cccc(c1)C(=O)Nc1ncccc1C

STK062909
Synonyms: N-[3-(diethylamino)propyl]-N'-(2-phenylethyl)butanediamide
Smiles: CCN(CCCNC(=O)CCC(=O)NCCc1ccccc1)CC

STK062912
Synonyms: ethyl(5-amino-1,3,4-thiadiazol-2-yl)acetate
Smiles: CCOC(=O)Cc1nnc(s1)N

STK062917
Synonyms: N-(furan-2-ylmethyl)-N-[(2,4,6-trimethylcyclohex-3-en-1-yl)methyl]acetamide
Smiles: CC1=CC(C(C(C1)C)CN(C(=O)C)Cc1ccco1)C

STK062922
Synonyms: 3-[(E)-{2-[(4-chloro-2-nitrophenoxy)acetyl]hydrazinylidene}methyl]phenyl3-fluorobenzoate
Smiles: O=C(COc1ccc(cc1[N+](=O)[O-])Cl)N/N=C/c1cccc(c1)OC(=O)c1cccc(c1)F

STK062972
Synonyms: 2-(2-hydroxy-3-methoxyphenyl)-7-methyl-2,3,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one
Smiles: COc1cccc(c1O)C1NC(=O)c2c(N1)sc1c2CCN(C1)C

STK062973
Synonyms: 1-(2-hydroxy-3-methoxybenzyl)-N-(1-methoxypropan-2-yl)piperidine-4-carboxamide
Smiles: COCC(NC(=O)C1CCN(CC1)Cc1cccc(c1O)OC)C

STK062977
Synonyms: 5-(4-methoxyphenyl)-1-(2-methylphenyl)-3-phenyl-4,5-dihydro-1H-pyrazole
Smiles: COc1ccc(cc1)C1CC(=NN1c1ccccc1C)c1ccccc1

STK063019
Synonyms: 4-(phenylcarbonyl)-1-(prop-2-en-1-ylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: C=CCSc1nnc2n1c1sc3c(c1c(=O)n2C(=O)c1ccccc1)CCCC3

STK063021
Synonyms: 2-cyclopentyl-5,7-dimethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: O=C1C2(C)CN3CC1(C)CN(C2)[C@@H]3C1CCCC1

STK063028
Synonyms: {[6,6-dimethyl-3-(2-methylprop-2-en-1-yl)-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetonitrile
Smiles: N#CCSc1nc2sc3c(c2c(=O)n1CC(=C)C)CC(OC3)(C)C

STK063029
Synonyms: 4-{[(E)-(2-ethoxyphenyl)methylidene]amino}-N-(4-fluorophenyl)benzenesulfonamide
Smiles: CCOc1ccccc1/C=N/c1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)F

STK063043
Synonyms: sodium(4-methoxy-6-methylpyrimidin-2-yl)(phenylsulfonyl)azanide
Smiles: COc1cc(C)nc(n1)N(S(=O)(=O)c1ccccc1)[Na]

STK063072
Synonyms: ethyl(2Z)-5-(2,5-dimethoxyphenyl)-2-(furan-2-ylmethylidene)-3-oxo-7-propyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCCC1=C(C(=O)OCC)C(n2c(=N1)s/c(=C\c1ccco1)/c2=O)c1cc(OC)ccc1OC

STK063087
Synonyms: N-{3-[(4-methoxyphenyl)carbamoyl]-4-methyl-5-phenylthiophen-2-yl}furan-2-carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1c(sc(c1C)c1ccccc1)NC(=O)c1ccco1

STK063095
Synonyms: 1-(4-chlorophenyl)-2-{[5-({2-oxo-2-[4-(phenylsulfanyl)phenyl]ethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}ethanone
Smiles: Clc1ccc(cc1)C(=O)CSc1nnc(s1)SCC(=O)c1ccc(cc1)Sc1ccccc1

STK063112
Synonyms: 5-chloro-8-(prop-2-yn-1-yloxy)quinoline
Smiles: C#CCOc1ccc(c2c1nccc2)Cl

STK063158
Synonyms: 4-[(4-methoxyphenyl)carbonyl]piperazin-2-one
Smiles: COc1ccc(cc1)C(=O)N1CCNC(=O)C1

STK063160
Synonyms: ethyl6-amino-4-(2-chloro-6-fluorophenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(OC(=C(C1c1c(F)cccc1Cl)C#N)N)c1ccccc1

STK063161
Synonyms: N-ethyl-5-(4-methoxyphthalazin-1-yl)-2-methylbenzenesulfonamide
Smiles: CCNS(=O)(=O)c1cc(ccc1C)c1nnc(c2c1cccc2)OC

STK063168
Synonyms: N'-(4-nitrophenyl)-2-(phenylcarbonyl)benzohydrazide
Smiles: O=C(c1ccccc1C(=O)NNc1ccc(cc1)[N+](=O)[O-])c1ccccc1

STK063191
Synonyms: 5,7-di(propan-2-yl)-6H-spiro[1,3-diazatricyclo[3.3.1.1~3,7~]decane-2,3'-indole]-2',6(1'H)-dione
Smiles: O=C1Nc2c(C31N1CC4(CN3CC(C1)(C4=O)C(C)C)C(C)C)cccc2

STK063199
Synonyms: 6-methyl-2-[(E)-2-(4-propoxyphenyl)ethenyl]-2,3-dihydro-1,3-benzoxazole
Smiles: CCCOc1ccc(cc1)/C=C/C1Nc2c(O1)cc(cc2)C

STK063218
Synonyms: N-(3-fluoro-2-methylphenyl)-2-({5-[(3-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)acetamide
Smiles: Cc1cccc(c1)OCc1nnc(o1)SCC(=O)Nc1cccc(c1C)F

STK063220
Synonyms: 2,7-diamino-5-hydroxy-8,8-dimethyl-4-(pyridin-3-yl)-7,8-dihydro-4H-pyrano[2',3':3,4]pyrazolo[1,5-c]pyrimidine-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccnc1)c1C(=CN(C(n1n2)(C)C)N)O

STK063229
Synonyms: 2-[(6,6-dimethyl-4-oxo-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-[(1-phenylcyclopentyl)methyl]acetamide
Smiles: O=C(CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CC(OC3)(C)C)NCC1(CCCC1)c1ccccc1

STK063230
Synonyms: N-benzyl-2-{3-chloro-4-[(6-methylheptyl)oxy]phenyl}acetamide
Smiles: CC(CCCCCOc1ccc(cc1Cl)CC(=O)NCc1ccccc1)C

STK063251
Synonyms: N-[5-(2-ethoxyethyl)-1,3,4-thiadiazol-2-yl]acetamide
Smiles: CCOCCc1nnc(s1)NC(=O)C

STK063261
Synonyms: (2Z)-N-(4-methoxyphenyl)-2-[(2-methoxyphenyl)imino]-3-methyl-4-oxo-1,3-thiazinane-6-carboxamide
Smiles: COc1ccc(cc1)NC(=O)C1CC(=O)N(/C(=N/c2ccccc2OC)/S1)C

STK063264
Synonyms: N-(2,4-dichlorophenyl)-4-hydroxy-1-methyl-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: Clc1ccc(c(c1)Cl)NC(=O)c1c(O)c2ccccc2n(c1=O)C

STK063268
Synonyms: 2-(4-ethoxyphenyl)-2,3-dihydro-4H-1,3-benzoxazin-4-one
Smiles: CCOc1ccc(cc1)C1NC(=O)c2c(O1)cccc2

STK063300
Synonyms: dipotassium3-phenyl-2-[({4-[(E)-piperidin-1-yldiazenyl]phenyl}sulfonyl)azanidyl]propanoate
Smiles: [O-]C(=O)C([N-]S(=O)(=O)c1ccc(cc1)/N=N/N1CCCCC1)Cc1ccccc1.[K+].[K+]

STK063332
Synonyms: (3Z)-1-[(3-methylpiperidin-1-yl)methyl]-3-{[3-(trifluoromethyl)phenyl]imino}-1,3-dihydro-2H-indol-2-one
Smiles: CC1CCCN(C1)CN1C(=O)/C(=N\c2cccc(c2)C(F)(F)F)/c2c1cccc2

STK063346
Synonyms: 3,5-dibromo-2-{[(2,2-dimethylpropanoyl)carbamothioyl]amino}benzoicacid
Smiles: S=C(NC(=O)C(C)(C)C)Nc1c(Br)cc(cc1C(=O)O)Br

STK063348
Synonyms: N'-(5,7-dinitroquinolin-8-yl)-4-methylbenzenesulfonohydrazide
Smiles: Cc1ccc(cc1)S(=O)(=O)NNc1c(cc(c2c1nccc2)[N+](=O)[O-])[N+](=O)[O-]

STK063363
Synonyms: N-(1,3-benzothiazol-2-yl)-3,4,5-triethoxybenzamide
Smiles: CCOc1c(OCC)cc(cc1OCC)C(=O)Nc1nc2c(s1)cccc2

STK063420
Synonyms: ethyl7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-carboxylate
Smiles: CCOC(=O)c1cnc2n(c1=O)cc(cc2)Cl

STK063443
Synonyms: 4-(3-cyclohexyl-1,2,4-oxadiazol-5-yl)phenol
Smiles: Oc1ccc(cc1)c1onc(n1)C1CCCCC1

STK063456
Synonyms: 2-[(E)-2-(3,4-dihydroquinolin-1(2H)-yl)ethenyl]-3-ethyl-1,3-benzothiazol-3-ium
Smiles: CC[n+]1c(/C=C/N2CCCc3c2cccc3)sc2c1cccc2

STK063457
Synonyms: 1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-di(propan-2-yl)-2,2'-binaphthalene-8,8'-dicarbaldehyde
Smiles: O=Cc1c(O)c(O)c(c2c1c(O)c(c(c2)C)c1c(C)cc2c(c1O)c(C=O)c(c(c2C(C)C)O)O)C(C)C

STK063471
Synonyms: 7-(2-fluorophenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Smiles: CC1=CC(n2c(N1)ncn2)c1ccccc1F

STK063493
Synonyms: N,N'-bis[(E)-1H-indol-3-ylmethylidene]-2-nitrobenzene-1,4-diamine
Smiles: [O-][N+](=O)c1cc(ccc1/N=C/c1c[nH]c2c1cccc2)/N=C/c1c[nH]c2c1cccc2

STK063494
Synonyms: 1-[(4-butoxyphenyl)carbonyl]-1H-indole-2,3-dione
Smiles: CCCCOc1ccc(cc1)C(=O)N1c2ccccc2C(=O)C1=O

STK063524
Synonyms: N,N'-bis(4-methoxyphenyl)-6-methylpyrimidine-2,4-diamine
Smiles: COc1ccc(cc1)Nc1cc(C)nc(n1)Nc1ccc(cc1)OC

STK063545
Synonyms: 4,4'-[benzene-1,4-diyldi(E)diazene-2,1-diyl]bis(N,N-dioctylaniline)
Smiles: CCCCCCCCN(c1ccc(cc1)/N=N/c1ccc(cc1)/N=N/c1ccc(cc1)N(CCCCCCCC)CCCCCCCC)CCCCCCCC

STK063548
Synonyms: 1-(3-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2,4,6-trimethylphenyl)ethanone
Smiles: Nc1nnc(s1)SCc1c(C)cc(c(c1C)C(=O)C)C

STK063549
Synonyms: 4,4'-(disulfanediyldi-1,3,4-oxadiazole-5,2-diyl)dipyridine
Smiles: n1ccc(cc1)c1nnc(o1)SSc1nnc(o1)c1ccncc1

STK063584
Synonyms: 5-phenyl-3-{[2-(pyridin-2-yl)ethyl]amino}cyclohex-2-en-1-one
Smiles: O=C1C=C(NCCc2ccccn2)CC(C1)c1ccccc1

STK063590
Synonyms: N-(1-hydroxy-2-methylpropan-2-yl)-1-(2-methoxybenzyl)piperidine-4-carboxamide
Smiles: OCC(NC(=O)C1CCN(CC1)Cc1ccccc1OC)(C)C

STK063595
Synonyms: 7,7-dimethyl-10-(3-nitrophenyl)-9-oxo-7,8,9,10-tetrahydro-6H-indeno[1,2-b]quinolin-11-ylacetate
Smiles: CC(=O)OC1=C2C(c3cccc(c3)[N+](=O)[O-])C3=C(N=C2c2c1cccc2)CC(CC3=O)(C)C

STK063597
Synonyms: ethyl(2E)-2-cyano-3-(2-methyl-1-{2-[2-(prop-2-en-1-yl)phenoxy]ethyl}-1H-indol-3-yl)prop-2-enoate
Smiles: C=CCc1ccccc1OCCn1c2ccccc2c(c1C)/C=C(/C(=O)OCC)\C#N

STK063611
Synonyms: 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(3,4-dichlorophenyl)pyrrolidine-2,5-dione
Smiles: O=C1CC(C(=O)N1c1ccc(c(c1)Cl)Cl)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK063629
Synonyms: 1-[(2E)-3-phenylprop-2-en-1-yl]-N-(prop-2-en-1-yl)piperidine-4-carboxamide
Smiles: C=CCNC(=O)C1CCN(CC1)C/C=C/c1ccccc1

STK063644
Synonyms: N-(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)-4-methyl-N-propylbenzenesulfonamide
Smiles: CCCN(S(=O)(=O)c1ccc(cc1)C)c1nc(C)c(c(n1)OC)Cl

STK063649
Synonyms: disodium4,5-dihydroxynaphthalene-2,7-disulfonate
Smiles: [Na]OS(=O)(=O)c1cc2cc(cc(c2c(c1)O)O)S(=O)(=O)O[Na]

STK063677
Synonyms: 1-[3-(4-fluorophenyl)-3-oxo-2-(2-oxopyridin-1(2H)-yl)propanoyl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide
Smiles: O=C(C1CCN(CC1)C(=O)C(n1ccccc1=O)C(=O)c1ccc(cc1)F)NCc1cccnc1

STK063685
Synonyms: potassium4-[(E)-piperidin-1-yldiazenyl]naphthalene-1-sulfonate
Smiles: [O-]S(=O)(=O)c1ccc(c2c1cccc2)/N=N/N1CCCCC1.[K+]

STK063715
Synonyms: 4-({[(4-chloro-3-methylphenoxy)acetyl]carbamothioyl}amino)benzoicacid
Smiles: O=C(NC(=S)Nc1ccc(cc1)C(=O)O)COc1ccc(c(c1)C)Cl

STK063730
Synonyms: N-{(2Z)-6-chloro-3-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-2H-chromen-2-ylidene}-1,3-thiazol-2-amine
Smiles: CCc1ccc(cc1)c1csc(n1)c1cc2cc(Cl)ccc2o/c/1=N\c1nccs1

STK063731
Synonyms: 2-hydroxy-4-(2-methyl-4-oxo-5-phenylpyrimidin-1(4H)-yl)benzoicacid
Smiles: O=c1nc(C)n(cc1c1ccccc1)c1ccc(c(c1)O)C(=O)O

STK063738
Synonyms: N-[4-(2-cyclohexylethoxy)phenyl]-N'-[2-(dimethylamino)ethyl]butanediamide
Smiles: CN(CCNC(=O)CCC(=O)Nc1ccc(cc1)OCCC1CCCCC1)C

STK063822
Synonyms: 1-[2-(4-chlorophenyl)ethyl]-5-hydroxy-3,4-dimethyl-1,5-dihydro-2H-pyrrol-2-one
Smiles: Clc1ccc(cc1)CCN1C(=O)C(=C(C1O)C)C

STK063829
Synonyms: N'-cyclododecyl-N,N-diphenylbutanediamide
Smiles: O=C(NC1CCCCCCCCCCC1)CCC(=O)N(c1ccccc1)c1ccccc1

STK063838
Synonyms: (5Z)-5-(3-ethyl-4,5-dimethyl-1,3-thiazol-2(3H)-ylidene)-3-methyl-1-phenyl-2-thioxoimidazolidin-4-one
Smiles: CCn1/c(=C/2\C(=O)N(C(=S)N2c2ccccc2)C)/sc(c1C)C

STK063848
Synonyms: 2-[(2E)-2-(3-{[4-(acetylamino)phenoxy]methyl}-4-methoxybenzylidene)hydrazinyl]benzoicacid
Smiles: COc1ccc(cc1COc1ccc(cc1)NC(=O)C)/C=N/Nc1ccccc1C(=O)O

STK063849
Synonyms: N-(3-chloro-2-methylphenyl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]acetamide
Smiles: OCCN1CCN(CC1)CC(=O)Nc1cccc(c1C)Cl

STK063858
Synonyms: N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-[(3-phenyl-1H-1,2,4-triazol-5-yl)sulfanyl]acetamide
Smiles: O=C(Nc1nnc(s1)C)CSc1[nH]nc(n1)c1ccccc1

STK063863
Synonyms: 3,4-diethoxy-N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]benzamide
Smiles: CCOc1cc(ccc1OCC)C(=O)Nc1nc2c(s1)cc(cc2)S(=O)(=O)C

STK063870
Synonyms: methyl4-cyano-5-{[(diphenylacetyl)carbamothioyl]amino}-3-methylthiophene-2-carboxylate
Smiles: COC(=O)c1sc(c(c1C)C#N)NC(=S)NC(=O)C(c1ccccc1)c1ccccc1

STK063890
Synonyms: 3-bromo-4-methoxy-N-[(4-methylpyridin-2-yl)carbamothioyl]benzamide
Smiles: COc1ccc(cc1Br)C(=O)NC(=S)Nc1nccc(c1)C

STK063922
Synonyms: (4-chlorophenyl)(2-methylpiperidin-1-yl)methanone
Smiles: Clc1ccc(cc1)C(=O)N1CCCCC1C

STK063927
Synonyms: 1-(2-ethoxybenzyl)-N-(1-hydroxy-2-methylpropan-2-yl)piperidine-4-carboxamide
Smiles: CCOc1ccccc1CN1CCC(CC1)C(=O)NC(CO)(C)C

STK063930
Synonyms: {2-[(4-methoxyphenyl)amino]quinolin-4-yl}(piperidin-1-yl)methanone
Smiles: COc1ccc(cc1)Nc1nc2ccccc2c(c1)C(=O)N1CCCCC1

STK063934
Synonyms: 7-butyl-3-methyl-8-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCn1c(SCC(=O)c2ccc(cc2)[N+](=O)[O-])nc2c1c(=O)[nH]c(=O)n2C

STK063938
Synonyms: N-(5-undecyl-1,3,4-thiadiazol-2-yl)dodecanamide
Smiles: CCCCCCCCCCCC(=O)Nc1nnc(s1)CCCCCCCCCCC

STK063954
Synonyms: N-(4-fluorophenyl)-2-[(6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)F)CSc1nc(cc(=O)[nH]1)c1ccccc1

STK063970
Synonyms: 4,4'-(1-methylcyclopropane-1,2-diyl)dibiphenyl
Smiles: CC1(CC1c1ccc(cc1)c1ccccc1)c1ccc(cc1)c1ccccc1

STK063987
Synonyms: (6Z)-5-imino-6-(4-{2-[(4-methylphenyl)sulfanyl]ethoxy}benzylidene)-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Smiles: Cc1ccc(cc1)SCCOc1ccc(cc1)/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1

STK064028
Synonyms: morpholin-4-yl(4-phenylcyclohexyl)methanone
Smiles: O=C(N1CCOCC1)C1CCC(CC1)c1ccccc1

STK064029
Synonyms: 4-bromo-N'-[(1E)-3-phenylprop-2-yn-1-ylidene]benzohydrazide
Smiles: Brc1ccc(cc1)C(=O)N/N=C/C#Cc1ccccc1

STK064030
Synonyms: 2-(3,5-di-tert-butyl-4-hydroxybenzyl)hydrazinecarbothioamide
Smiles: NC(=S)NNCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C

STK064041
Synonyms: N-[5-(imidazo[1,2-a]pyridin-2-yl)-4-methyl-1,3-thiazol-2-yl]acetamide
Smiles: CC(=O)Nc1sc(c(n1)C)c1nc2n(c1)cccc2

STK064047
Synonyms: 5-(2-hydroxy-1,3-dioxo-2,3-dihydro-1H-inden-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)C(C(=O)N1)C1(O)C(=O)c2c(C1=O)cccc2

STK064058
Synonyms: N,N-diethyl-3-(4-fluorophenyl)-3-oxo-2-(2-oxopyridin-1(2H)-yl)propanamide
Smiles: CCN(C(=O)C(n1ccccc1=O)C(=O)c1ccc(cc1)F)CC

STK064059
Synonyms: 2,4-dichloro-N,N-dioctylbenzamide
Smiles: CCCCCCCCN(C(=O)c1ccc(cc1Cl)Cl)CCCCCCCC

STK064075
Synonyms: 5-chloro-4-{[(3,5-dimethoxyphenyl)carbonyl]amino}-2-methoxybenzoicacid
Smiles: COc1cc(OC)cc(c1)C(=O)Nc1cc(OC)c(cc1Cl)C(=O)O

STK064106
Synonyms: 3-{5-[(E)-{2-[(4-chlorophenoxy)acetyl]hydrazinylidene}methyl]furan-2-yl}benzoicacid
Smiles: O=C(COc1ccc(cc1)Cl)N/N=C/c1ccc(o1)c1cccc(c1)C(=O)O

STK064131
Synonyms: 1-[(1E)-1-(4-ethoxyphenyl)-3-oxo-3-(piperidin-1-yl)prop-1-en-2-yl]pyridin-2(1H)-one
Smiles: CCOc1ccc(cc1)/C=C(/n1ccccc1=O)\C(=O)N1CCCCC1

STK064133
Synonyms: 6-methyl-4-(2-nitrophenyl)-2-oxo-N-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Smiles: O=C1NC(=C(C(N1)c1ccccc1[N+](=O)[O-])C(=O)Nc1ccccc1)C

STK064187
Synonyms: 1-(azepan-1-yl)-3-(3-nitrophenyl)-2-(2-oxopyridin-1(2H)-yl)propane-1,3-dione
Smiles: O=c1ccccn1C(C(=O)c1cccc(c1)[N+](=O)[O-])C(=O)N1CCCCCC1

STK064193
Synonyms: N-{(E)-amino[(5-nitro-1,3-benzoxazol-2-yl)amino]methylidene}acetamide
Smiles: N/C(=N\C(=O)C)/Nc1nc2c(o1)ccc(c2)[N+](=O)[O-]

STK064201
Synonyms: 1-(2-fluorophenyl)-4-[(3-methylthiophen-2-yl)methyl]piperazine
Smiles: Fc1ccccc1N1CCN(CC1)Cc1sccc1C

STK064210
Synonyms: pyridin-3-yl2,3-dihydro-1,4-benzodioxine-2-carboxylate
Smiles: O=C(C1COc2c(O1)cccc2)Oc1cccnc1

STK064233
Synonyms: 3,3'-[(5-chloro-2-hydroxyphenyl)methanediyl]bis(4-hydroxy-2H-chromen-2-one)
Smiles: Clc1ccc(c(c1)C(c1c(=O)oc2c(c1O)cccc2)c1c(=O)oc2c(c1O)cccc2)O

STK064246
Synonyms: 2-(2-bromophenyl)-2-oxoethyl3-bromo-3-phenylpropanoate
Smiles: O=C(CC(c1ccccc1)Br)OCC(=O)c1ccccc1Br

STK064256
Synonyms: 1-(5-butyl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea
Smiles: CCCCc1nnc(s1)NC(=O)Nc1ccc(c(c1)C)C

STK064263
Synonyms: 5-({1-[2-(2-methoxyphenoxy)ethyl]-2-methyl-1H-indol-3-yl}methylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccccc1OCCn1c2ccccc2c(c1C)C=C1C(=O)N(C)C(=O)N(C1=O)C

STK064267
Synonyms: 2-(4-ethylphenyl)-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4-ol
Smiles: CCc1ccc(cc1)C1N=C(O)c2c(N1)sc1c2CCCC1

STK064325
Synonyms: 2,6-diamino-4-(1-phenylethyl)-4H-thiopyran-3,5-dicarbonitrile
Smiles: CC(C1C(=C(N)SC(=C1C#N)N)C#N)c1ccccc1

STK064329
Synonyms: (3Z)-5-bromo-3-(phenylimino)-1-(piperidin-1-ylmethyl)-1,3-dihydro-2H-inden-2-one
Smiles: Brc1ccc2c(c1)/C(=N/c1ccccc1)/C(=O)C2CN1CCCCC1

STK064331
Synonyms: 4-[(4E)-3-methyl-5-oxo-4-{[5-(3-oxo-1,3-dihydro-2-benzofuran-5-yl)furan-2-yl]methylidene}-4,5-dihydro-1H-pyrazol-1-yl]benzenesulfonicacid
Smiles: CC1=NN(C(=O)/C/1=C/c1ccc(o1)c1ccc2c(c1)C(=O)OC2)c1ccc(cc1)S(=O)(=O)O

STK064377
Synonyms: ethyl(2Z)-5-(3,4-dimethoxyphenyl)-7-methyl-2-[(5-nitrofuran-2-yl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C/c1ccc(o1)[N+](=O)[O-])/s2

STK064397
Synonyms: N-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-2-oxoethyl]-3-phenylpropanamide
Smiles: O=C(CCc1ccccc1)NCC(=O)n1nc(cc1C)C

STK064405
Synonyms: 1-(4-methylpiperidin-1-yl)-3-(3-nitrophenyl)-2-(2-oxopyridin-1(2H)-yl)propane-1,3-dione
Smiles: CC1CCN(CC1)C(=O)C(n1ccccc1=O)C(=O)c1cccc(c1)[N+](=O)[O-]

STK064412
Synonyms: 3'-(4-chlorophenyl)-4'H-spiro[indole-3,2'-[1,3]thiazolidine]-2,4'(1H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)CSC21C(=O)Nc1c2cccc1

STK064424
Synonyms: (2E)-3-{3-chloro-4-[2-(4-methoxyphenoxy)ethoxy]phenyl}-2-cyano-N-(furan-2-ylmethyl)prop-2-enamide
Smiles: N#C/C(=C\c1ccc(c(c1)Cl)OCCOc1ccc(cc1)OC)/C(=O)NCc1ccco1

STK064429
Synonyms: N'-[(E)-(5-bromo-2-hydroxy-3-iodophenyl)methylidene]-2-[4-(propan-2-yl)phenoxy]acetohydrazide
Smiles: O=C(COc1ccc(cc1)C(C)C)N/N=C/c1cc(Br)cc(c1O)I

STK064431
Synonyms: 3-methyl-N-(pyridin-4-yl)butanamide
Smiles: CC(CC(=O)Nc1ccncc1)C

STK064439
Synonyms: N-butyl-1-[2-(5-chloro-2-oxopyridin-1(2H)-yl)-3-oxo-3-phenylpropanoyl]piperidine-4-carboxamide
Smiles: CCCCNC(=O)C1CCN(CC1)C(=O)C(n1cc(Cl)ccc1=O)C(=O)c1ccccc1

STK064487
Synonyms: 1-tert-butyl-5-(tert-butylamino)-3,4-dimethyl-1,5-dihydro-2H-pyrrol-2-one
Smiles: CC1=C(C)C(N(C1=O)C(C)(C)C)NC(C)(C)C

STK064492
Synonyms: N-(4-chlorophenyl)-6-methyl-2-{[(3-methylphenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: CC1CCc2c(C1)sc(c2C(=O)Nc1ccc(cc1)Cl)NC(=O)c1cccc(c1)C

STK064497
Synonyms: N-[5-(4-ethoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide
Smiles: CCOc1ccc(cc1)c1nnc(s1)NC(=O)CCc1ccccc1

STK064522
Synonyms: 4-{[3-(naphthalen-1-ylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]amino}-4-oxobutanoicacid
Smiles: O=C(Nc1sc2c(c1C(=O)Nc1cccc3c1cccc3)CCC2)CCC(=O)O

STK064534
Synonyms: prop-2-en-1-yl(7-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)carbamodithioate
Smiles: Cc1cc(=O)n2c(n1)sc(n2)NC(=S)SCC=C

STK064595
Synonyms: 4,4'-diaminobiphenyl-3,3'-disulfonicacid
Smiles: Nc1ccc(cc1S(=O)(=O)O)c1ccc(c(c1)S(=O)(=O)O)N

STK064596
Synonyms: 2-(1,3-benzothiazol-2-yl)-7,7,9-trimethyl-1,2,4-triazaspiro[4.5]decane-3-thione
Smiles: CC1CC(C)(C)CC2(C1)NC(=S)N(N2)c1nc2c(s1)cccc2

STK064618
Synonyms: quinoline-8-carbaldehyde
Smiles: O=Cc1cccc2c1nccc2

STK064624
Synonyms: (4Z)-4-{3-chloro-4-[2-(3,5-dimethylphenoxy)ethoxy]-5-ethoxybenzylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCOc1cc(/C=C\2/C(=NN(C2=O)c2ccccc2)C)cc(c1OCCOc1cc(C)cc(c1)C)Cl

STK064665
Synonyms: 4-fluoro-N-[(E)-(4-methoxynaphthalen-1-yl)methylidene]aniline
Smiles: COc1ccc(c2c1cccc2)/C=N/c1ccc(cc1)F

STK064666
Synonyms: N-[4-(benzyloxy)phenyl]-2,5-dichlorobenzenesulfonamide
Smiles: Clc1ccc(c(c1)S(=O)(=O)Nc1ccc(cc1)OCc1ccccc1)Cl

STK064679
Synonyms: (6Z)-6-(3-chlorobenzylidene)-5-imino-2-(propan-2-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Clc1cccc(c1)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)C(C)C

STK064693
Synonyms: (6Z)-6-{4-[2-(3,4-dimethylphenoxy)ethoxy]-3-ethoxy-5-iodobenzylidene}-5-imino-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Smiles: CCOc1cc(cc(c1OCCOc1ccc(c(c1)C)C)I)/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1

STK064713
Synonyms: N-{4-[(2Z)-2-{1-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene}hydrazinyl]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)N/N=C\1/C(=NN(C1=O)c1scc(n1)c1ccc(cc1)C)c1ccc(cc1)[N+](=O)[O-]

STK064758
Synonyms: 1-amino-7,7-dimethyl-1,6,7,9-tetrahydro-5H-imidazo[1,2-a]pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,5(3H)-dione
Smiles: O=C1Cn2c(N1N)nc1c(c2=O)c2CC(C)(C)OCc2s1

STK064782
Synonyms: 4b,9b-dihydroxy-4b,9b-dihydro-10H-benzo[b]indeno[2,1-d]furan-10-one
Smiles: O=C1c2ccccc2C2(C1(O)c1ccccc1O2)O

STK064788
Synonyms: dimethyl2-{[(E)-(4-cyano-1-hydroxy-3-methylpyrido[1,2-a]benzimidazol-2-yl)methylidene]amino}benzene-1,4-dicarboxylate
Smiles: COC(=O)c1ccc(cc1/N=C/c1c(C)c(C#N)c2n(c1O)c1ccccc1n2)C(=O)OC

STK064798
Synonyms: N-(5-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide
Smiles: O=C(Nc1nnc(s1)SCC(=O)c1ccc(cc1)Br)CCc1ccccc1

STK064807
Synonyms: (1Z)-2-{4-[(5-methylhexyl)oxy]phenyl}-N'-(4H-1,2,4-triazol-4-yl)ethanimidamide
Smiles: CC(CCCCOc1ccc(cc1)C/C(=N/n1cnnc1)/N)C

STK064826
Synonyms: 2-(4-chloro-3-methylphenoxy)-N-[(4-methylpyridin-2-yl)carbamothioyl]acetamide
Smiles: O=C(NC(=S)Nc1nccc(c1)C)COc1ccc(c(c1)C)Cl

STK064835
Synonyms: 4-(morpholin-4-yl)-4-oxo-N-(pyridin-3-yl)butanamide
Smiles: O=C(Nc1cccnc1)CCC(=O)N1CCOCC1

STK064850
Synonyms: 4b,9b-dihydroxy-1,4b,9b,10-tetrahydroindeno[2',1':4,5]pyrrolo[2,3-d]pyrimidine-2,4,5(3H)-trione
Smiles: O=c1[nH]c2NC3(C(c2c(=O)[nH]1)(O)C(=O)c1c3cccc1)O

STK064854
Synonyms: (3Z,3'Z)-3,3'-[methanediylbis(benzene-4,1-diylnitrilo)]bis(1,3-dihydro-2H-indol-2-one)
Smiles: O=C1Nc2c(/C/1=N/c1ccc(cc1)Cc1ccc(cc1)/N=C/1\C(=O)Nc3c1cccc3)cccc2

STK064868
Synonyms: (6Z)-5-imino-6-[4-(propan-2-yl)benzylidene]-2-propyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCCc1nn2c(=NC(=O)/C(=C\c3ccc(cc3)C(C)C)/C2=N)s1

STK064906
Synonyms: (6Z)-2-butyl-5-imino-6-[3-methoxy-4-(naphthalen-1-ylmethoxy)benzylidene]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCCCc1nn2c(=NC(=O)/C(=C\c3ccc(c(c3)OC)OCc3cccc4c3cccc4)/C2=N)s1

STK064909
Synonyms: (2Z)-2-(propan-2-ylimino)-2H-chromene-3-carboxamide
Smiles: CC(/N=c/1\oc2ccccc2cc1C(=O)N)C

STK064913
Synonyms: 3-(butan-2-yloxy)-2-(3-methylbutyl)-2,3-dihydro-1H-isoindol-1-one
Smiles: CCC(OC1N(CCC(C)C)C(=O)c2c1cccc2)C

STK064916
Synonyms: 2-(hex-1-yn-1-yl)-5,5,6-trimethylbicyclo[2.2.1]hept-2-ylmethylether
Smiles: CCCCC#CC1(OC)CC2CC1C(C2(C)C)C

STK064933
Synonyms: 1,8-dihydroxy-4,5-bis(methylamino)anthracene-9,10-dione
Smiles: CNc1ccc(c2c1C(=O)c1c(C2=O)c(O)ccc1NC)O

STK064934
Synonyms: 2-[(2-aminoethyl)sulfanyl]-3-benzyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: NCCSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCCC3

STK064950
Synonyms: 1H-benzimidazol-1-yl(furan-2-yl)methanone
Smiles: O=C(n1cnc2c1cccc2)c1ccco1

STK064973
Synonyms: N-(4-chlorophenyl)-2-{(2Z)-2-[(3,4-dimethylphenyl)imino]-4-oxo-1,3-thiazolidin-5-yl}acetamide
Smiles: O=C(CC1S/C(=N\c2ccc(c(c2)C)C)/NC1=O)Nc1ccc(cc1)Cl

STK065008
Synonyms: N-(butan-2-yl)-1,3-benzodioxole-5-carboxamide
Smiles: CCC(NC(=O)c1ccc2c(c1)OCO2)C

STK065023
Synonyms: 4-methyl-N-[4-(naphthalen-1-ylcarbamoyl)phenyl]benzamide
Smiles: Cc1ccc(cc1)C(=O)Nc1ccc(cc1)C(=O)Nc1cccc2c1cccc2

STK065026
Synonyms: (4-methoxyphenyl)[1-methyl-2-(methylsulfanyl)-4-phenyl-4,5-dihydro-1H-imidazol-5-yl]methanone
Smiles: COc1ccc(cc1)C(=O)C1N(C)C(=NC1c1ccccc1)SC

STK065035
Synonyms: 7-(diethylamino)-3-[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-2H-chromen-2-one
Smiles: CCN(c1ccc2c(c1)oc(=O)c(c2)c1nnc(o1)c1ccccc1OC)CC

STK065048
Synonyms: N'-[(1E)-1-(5-bromothiophen-2-yl)ethylidene]-2-(2-methylphenoxy)acetohydrazide
Smiles: O=C(COc1ccccc1C)N/N=C(/c1ccc(s1)Br)\C

STK065054
Synonyms: 11-phenylimidazo[1,2-b]phenanthro[9,10-e][1,2,4]triazine
Smiles: c1ccc(cc1)c1nc2n(c1)nc1c(n2)c2ccccc2c2c1cccc2

STK065067
Synonyms: 3-(4-chlorophenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-amine
Smiles: Clc1ccc(cc1)c1c(C)nn2c1nc(C)cc2N

STK065091
Synonyms: 2-(3-{(E)-[1-(2-fluorobenzyl)-2,5-dioxoimidazolidin-4-ylidene]methyl}-1H-indol-1-yl)-N-(3-methylphenyl)acetamide
Smiles: Cc1cccc(c1)NC(=O)Cn1cc(c2c1cccc2)/C=C\1/NC(=O)N(C1=O)Cc1ccccc1F

STK065092
Synonyms: 2-{[(E)-(2-hydroxyphenyl)methylidene]amino}-4-propylphenol
Smiles: CCCc1ccc(c(c1)/N=C/c1ccccc1O)O

STK065102
Synonyms: 5-amino-1,3-diphenyl-1H-pyrazole-4-carbonitrile
Smiles: N#Cc1c(nn(c1N)c1ccccc1)c1ccccc1

STK065155
Synonyms: N'-(2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide
Smiles: O=C1NC(=O)C(=NNC(=O)C2COc3c(O2)cccc3)C(=O)N1

STK065175
Synonyms: N-[(4-methylpyridin-2-yl)carbamothioyl]-2-phenoxyacetamide
Smiles: O=C(NC(=S)Nc1nccc(c1)C)COc1ccccc1

STK065179
Synonyms: 4-[(4E)-3-methyl-5-oxo-4-{[5-(3-oxo-1,3-dihydro-2-benzofuran-5-yl)furan-2-yl]methylidene}-4,5-dihydro-1H-pyrazol-1-yl]benzoicacid
Smiles: CC1=NN(C(=O)/C/1=C/c1ccc(o1)c1ccc2c(c1)C(=O)OC2)c1ccc(cc1)C(=O)O

STK065183
Synonyms: N'-{2,5-dimethoxy-4-[(phenylcarbonyl)amino]phenyl}-N,N-dimethylbutanediamide
Smiles: COc1cc(NC(=O)c2ccccc2)c(cc1NC(=O)CCC(=O)N(C)C)OC

STK065204
Synonyms: [4-(4-benzylphenyl)-2-methyl-1,3-thiazol-5-yl]aceticacid
Smiles: OC(=O)Cc1sc(nc1c1ccc(cc1)Cc1ccccc1)C

STK065225
Synonyms: N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-3,4-dimethylbenzamide
Smiles: O=C(c1ccc(c(c1)C)C)Nc1nnc(s1)CC(C)(C)C

STK065237
Synonyms: 4-benzyl-N-[(E)-(2-methylphenyl)methylidene]piperazin-1-amine
Smiles: Cc1ccccc1/C=N/N1CCN(CC1)Cc1ccccc1

STK065245
Synonyms: methyl2-{[(2E)-4-methoxy-4-oxobut-2-enoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)/C=C/C(=O)Nc1sc2c(c1C(=O)OC)CCCC2

STK065258
Synonyms: 3,3,6,6-tetramethyl-10-(4-methylphenyl)-9-(1-methyl-1H-pyrazol-4-yl)decahydroacridine-1,8(2H,5H)-dione
Smiles: O=C1CC(C)(C)CC2C1C(c1cnn(c1)C)C1C(=O)CC(CC1N2c1ccc(cc1)C)(C)C

STK065274
Synonyms: 2-(4-chlorophenyl)-5-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
Smiles: Clc1ccc(cc1)c1nn2c(c1)nc(cc2C(F)(F)F)C

STK065302
Synonyms: N-(2-chloro-6-fluorobenzyl)-4-methyl-N-[2-oxo-2-(pyrrolidin-1-yl)ethyl]benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N(Cc1c(F)cccc1Cl)CC(=O)N1CCCC1

STK065304
Synonyms: 2-tert-butyl-5-(4-hydroxy-3-nitrobenzylidene)-2-methyl-1,3-dioxane-4,6-dione
Smiles: O=C1OC(C)(OC(=O)/C/1=C\c1ccc(c(c1)[N+](=O)[O-])O)C(C)(C)C

STK065308
Synonyms: 1-{(E)-amino[(6-ethoxy-4-methylquinazolin-2-yl)amino]methylidene}-3-cyclohexylurea
Smiles: CCOc1ccc2c(c1)c(C)nc(n2)N/C(=N/C(=O)NC1CCCCC1)/N

STK065323
Synonyms: ethyl1-[3-(benzyloxy)benzyl]piperidine-2-carboxylate
Smiles: CCOC(=O)C1CCCCN1Cc1cccc(c1)OCc1ccccc1

STK065343
Synonyms: N-[(E)-pyridin-3-ylmethylidene]pyridin-2-amine
Smiles: c1ccc(nc1)/N=C/c1cccnc1

STK065349
Synonyms: ethyl(2E)-2-[2-({[(4-ethoxyphenyl)sulfonyl](4-methylphenyl)amino}acetyl)hydrazinylidene]cyclopentanecarboxylate(non-preferredname)
Smiles: CCOC(=O)C1CCC/C/1=N\NC(=O)CN(S(=O)(=O)c1ccc(cc1)OCC)c1ccc(cc1)C

STK065351
Synonyms: 2-methyl-2-[(4-phenylbutan-2-yl)amino]propanenitrile
Smiles: CC(NC(C#N)(C)C)CCc1ccccc1

STK065352
Synonyms: 2-[(bromoacetyl)amino]-N-(2-ethoxyphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Smiles: CCOc1ccccc1NC(=O)c1c(NC(=O)CBr)sc2c1CCCCC2

STK065381
Synonyms: 4-[(E)-2-phenylethenyl]aniline
Smiles: Nc1ccc(cc1)/C=C/c1ccccc1

STK065398
Synonyms: (4Z)-2-acetyl-5-chloro-N-(4-methoxyphenyl)hex-4-enamide
Smiles: COc1ccc(cc1)NC(=O)C(C(=O)C)C/C=C(\Cl)/C

STK065438
Synonyms: ethyl{5-[(phenylcarbamoyl)amino]-1,3,4-thiadiazol-2-yl}acetate
Smiles: CCOC(=O)Cc1nnc(s1)NC(=O)Nc1ccccc1

STK065444
Synonyms: 3,4-dimethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)-5-[(thiophen-2-ylmethyl)amino]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CC1=C(C)C(N(C1=O)C1CCCc2c1cccc2)NCc1cccs1

STK065453
Synonyms: N'-(3-cyclohexyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-4-(2-methylpropoxy)benzohydrazide
Smiles: CC(COc1ccc(cc1)C(=O)NNc1nc2sc3c(c2c(=O)n1C1CCCCC1)CCCC3)C

STK065455
Synonyms: 2-[(5-methyl-1,4-diphenyl-1H-imidazol-2-yl)sulfanyl]-N-(2-phenylethyl)acetamide
Smiles: O=C(CSc1nc(c(n1c1ccccc1)C)c1ccccc1)NCCc1ccccc1

STK065467
Synonyms: 2-phenylproline
Smiles: OC(=O)C1(CCCN1)c1ccccc1

STK065469
Synonyms: 2-(1H-indol-1-yl)-N'-[(1Z)-1-(thiophen-2-yl)ethylidene]acetohydrazide
Smiles: O=C(Cn1ccc2c1cccc2)N/N=C(\c1cccs1)/C

STK065492
Synonyms: (2E)-N-(4-methoxybenzyl)-2-{1-[4-(2-methylpropoxy)phenyl]ethylidene}hydrazinecarbothioamide
Smiles: COc1ccc(cc1)CNC(=S)N/N=C(/c1ccc(cc1)OCC(C)C)\C

STK065501
Synonyms: bis(1,2-dimethyl-1H-indol-3-yl)mercury
Smiles: Cn1c(C)c(c2c1cccc2)[Hg]c1c(C)n(c2c1cccc2)C

STK065520
Synonyms: N-[(4-methylphenyl)sulfonyl]histidine
Smiles: OC(=O)C(NS(=O)(=O)c1ccc(cc1)C)Cc1[nH]cnc1

STK065576
Synonyms: 1-{5-[(2-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-(4-methoxyphenyl)urea
Smiles: COc1ccc(cc1)NC(=O)Nc1nnc(s1)COc1ccccc1Cl

STK065578
Synonyms: 4-(2-{[5-(benzyloxy)-2-methyl-1H-indol-3-yl]acetyl}hydrazinyl)-N-(4-cyanophenyl)-4-oxobutanamide
Smiles: N#Cc1ccc(cc1)NC(=O)CCC(=O)NNC(=O)Cc1c(C)[nH]c2c1cc(OCc1ccccc1)cc2

STK065588
Synonyms: 4-(trifluoromethoxy)-N-[(E)-(2,4,6-trimethylphenyl)methylidene]aniline
Smiles: Cc1cc(C)c(c(c1)C)/C=N/c1ccc(cc1)OC(F)(F)F

STK065607
Synonyms: (2E)-3-{3-bromo-4-[(2,4-dichlorobenzyl)oxy]-5-methoxyphenyl}-2-cyano-N-(3,4-dimethylphenyl)prop-2-enamide
Smiles: N#C/C(=C\c1cc(Br)c(c(c1)OC)OCc1ccc(cc1Cl)Cl)/C(=O)Nc1ccc(c(c1)C)C

STK065609
Synonyms: 4-[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-6-(morpholin-4-yl)-N-phenyl-1,3,5-triazin-2-amine
Smiles: FC(C(C(F)(F)F)Oc1nc(Nc2ccccc2)nc(n1)N1CCOCC1)(F)F

STK065652
Synonyms: N-[(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)carbamothioyl]benzamide
Smiles: N#Cc1c(NC(=S)NC(=O)c2ccccc2)sc2c1CCN(C2)C(C)(C)C

STK065669
Synonyms: N'-(2,4-dinitrophenyl)-4'-(trifluoromethyl)biphenyl-2-carbohydrazide
Smiles: O=C(c1ccccc1c1ccc(cc1)C(F)(F)F)NNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

STK065673
Synonyms: N-[4-(4-benzylphenyl)-5-methyl-1,3-thiazol-2-yl]-6-bromo-2-oxo-2H-chromene-3-carboxamide
Smiles: Brc1ccc2c(c1)cc(c(=O)o2)C(=O)Nc1sc(c(n1)c1ccc(cc1)Cc1ccccc1)C

STK065684
Synonyms: (4E)-4-[2-(4-chlorophenyl)hydrazinylidene]-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: Clc1ccc(cc1)N/N=C/1\C(=NN(C1=O)c1ccc(cc1)[N+](=O)[O-])C

STK065693
Synonyms: N-methyl-4-nitrobenzamide-4-chloro-2-(iminomethyl)phenol(1:1)
Smiles: CNC(=O)c1ccc(cc1)[N+](=O)[O-].N=Cc1cc(Cl)ccc1O

STK065702
Synonyms: 2-benzyl-1,2,3,4,4a,9b-hexahydro-5H-indeno[1,2-c]pyridin-5-one
Smiles: O=C1C2CCN(CC2c2c1cccc2)Cc1ccccc1

STK065728
Synonyms: 2-({[4-(3,4-dimethoxyphenyl)-5-propyl-1,3-thiazol-2-yl]amino}methyl)phenol
Smiles: CCCc1sc(nc1c1ccc(c(c1)OC)OC)NCc1ccccc1O

STK065735
Synonyms: N-[3-(morpholin-4-yl)propyl]-3-(3-nitrophenyl)-3-oxo-2-(2-oxopyridin-1(2H)-yl)propanamide
Smiles: O=C(C(n1ccccc1=O)C(=O)c1cccc(c1)[N+](=O)[O-])NCCCN1CCOCC1

STK065753
Synonyms: 11-methyl-N-[2-(trifluoromethyl)phenyl]-9,10-dihydro-9,10-ethanoanthracene-11-carboxamide
Smiles: O=C(C1(C)CC2c3c(C1c1c2cccc1)cccc3)Nc1ccccc1C(F)(F)F

STK065828
Synonyms: N,N,N-triethyl-2-oxo-2-(9-oxo-1,2,3,3a-tetrahydropyrrolo[2,1-b]quinazolin-4(9H)-yl)ethanaminium
Smiles: CC[N+](CC(=O)N1C2CCCN2C(=O)c2c1cccc2)(CC)CC

STK065846
Synonyms: N-butyl-1-(3-methoxybenzyl)piperidine-4-carboxamide
Smiles: CCCCNC(=O)C1CCN(CC1)Cc1cccc(c1)OC

STK065853
Synonyms: methyl(4-hydroxy-3-methoxyphenyl){[(5-propoxy-1H-indol-2-yl)carbonyl]amino}acetate
Smiles: CCCOc1ccc2c(c1)cc([nH]2)C(=O)NC(c1ccc(c(c1)OC)O)C(=O)OC

STK065869
Synonyms: 1-(1,3-thiazolidin-2-yl)butane-1,2,3,4-tetrol
Smiles: OCC(C(C(C1NCCS1)O)O)O

STK065879
Synonyms: N,N'-[(2,2',3,3',5,5',6,6'-octafluorobiphenyl-4,4'-diyl)bis(oxybenzene-3,1-diyl)]bis(2,2,2-trifluoroacetamide)
Smiles: O=C(C(F)(F)F)Nc1cccc(c1)Oc1c(F)c(F)c(c(c1F)F)c1c(F)c(F)c(c(c1F)F)Oc1cccc(c1)NC(=O)C(F)(F)F

STK065884
Synonyms: [1-(4-methoxybenzyl)piperidin-4-yl](4-methylpiperidin-1-yl)methanone
Smiles: COc1ccc(cc1)CN1CCC(CC1)C(=O)N1CCC(CC1)C

STK065922
Synonyms: N'-(2-cyanocyclopent-1-en-1-yl)-N,N-dimethylimidoformamide
Smiles: N#CC1=C(CCC1)/N=C/N(C)C

STK065928
Synonyms: N-(4-ethylphenyl)-1H-1,2,4-triazole-3-carboxamide
Smiles: CCc1ccc(cc1)NC(=O)c1n[nH]cn1

STK065933
Synonyms: dimethyl2-[(3,3-dimethylbutanoyl)amino]benzene-1,4-dicarboxylate
Smiles: COC(=O)c1ccc(cc1NC(=O)CC(C)(C)C)C(=O)OC

STK065934
Synonyms: 5-[(2-cyclohexylpropan-2-yl)peroxy]-5-methylhex-3-yn-2-one
Smiles: CC(=O)C#CC(OOC(C1CCCCC1)(C)C)(C)C

STK065973
Synonyms: 3-(5-{(Z)-[5-imino-2-(2-methylpropyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}furan-2-yl)benzoicacid
Smiles: CC(Cc1nn2c(=NC(=O)/C(=C\c3ccc(o3)c3cccc(c3)C(=O)O)/C2=N)s1)C

STK065979
Synonyms: N-{1-[1-(diphenylmethyl)-1H-tetrazol-5-yl]-2-methylpropyl}-4-methylaniline
Smiles: CC(C(c1nnnn1C(c1ccccc1)c1ccccc1)Nc1ccc(cc1)C)C

STK065980
Synonyms: [2-(4-bromophenoxy)ethyl](4,6-dimethylpyrimidin-2-yl)cyanamide
Smiles: N#CN(c1nc(C)cc(n1)C)CCOc1ccc(cc1)Br

STK065982
Synonyms: 3-benzyl-4-(cyclohexylamino)-4-oxobutanoicacid
Smiles: OC(=O)CC(C(=O)NC1CCCCC1)Cc1ccccc1

STK065994
Synonyms: methyl(piperidin-1-ylmethyl)phosphinicacid
Smiles: CP(=O)(CN1CCCCC1)O

STK066006
Synonyms: N-(1-phenylethyl)-N'-(1,3-thiazol-2-yl)ethanediamide
Smiles: O=C(C(=O)NC(c1ccccc1)C)Nc1nccs1

STK066052
Synonyms: 1-(3,5-dimethyl-1H-pyrazol-1-yl)-3-phenylpropan-1-one
Smiles: Cc1nn(c(c1)C)C(=O)CCc1ccccc1

STK066060
Synonyms: N-benzyl-N',N'-dimethyl-N-{[2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-yl]methyl}ethane-1,2-diamine
Smiles: CN(CCN(Cc1c(nc2n1cccc2)c1ccc(cc1)[N+](=O)[O-])Cc1ccccc1)C

STK066072
Synonyms: N-(4-chlorophenyl)-N'-(4-nitrophenyl)butanediamide
Smiles: O=C(Nc1ccc(cc1)[N+](=O)[O-])CCC(=O)Nc1ccc(cc1)Cl

STK066119
Synonyms: 2-[(4-chlorophenyl)amino]-4,6-diphenylpyridine-3-carbonitrile
Smiles: N#Cc1c(Nc2ccc(cc2)Cl)nc(cc1c1ccccc1)c1ccccc1

STK066165
Synonyms: 3-(prop-2-en-1-yl)-2-(prop-2-en-1-ylsulfanyl)-3,4b,5,6,7,7a-hexahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-imine
Smiles: C=CCSc1nc2SC3C(c2c(=N)n1CC=C)CCC3

STK066179
Synonyms: 2-{[3-(propan-2-yloxy)propyl]carbamoyl}cyclohex-1-ene-1-carboxylicacid
Smiles: CC(OCCCNC(=O)C1=C(CCCC1)C(=O)O)C

STK066193
Synonyms: 4-(azepan-1-yl)-4-oxo-N-(tetrahydrofuran-2-ylmethyl)butanamide
Smiles: O=C(CCC(=O)N1CCCCCC1)NCC1CCCO1

STK066223
Synonyms: N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)-2-methoxybenzamide
Smiles: COc1ccccc1C(=O)Nc1c2CCCc2nc2c1CCCC2

STK066250
Synonyms: {4-phenyl-2-[2-(propan-2-ylidene)hydrazinyl]-1,3-thiazol-5-yl}aceticacid
Smiles: OC(=O)Cc1sc(nc1c1ccccc1)NN=C(C)C

STK066252
Synonyms: 1,4-bis(4,4,8-trimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)butane-1,4-dione
Smiles: Cc1ccc2c(c1)c1c(=S)ssc1C(N2C(=O)CCC(=O)N1c2ccc(cc2c2c(C1(C)C)ssc2=S)C)(C)C

STK066268
Synonyms: 3,4-dihydroxy-1-methylquinolin-2(1H)-one
Smiles: Oc1c(O)c2ccccc2n(c1=O)C

STK066272
Synonyms: 6-(4-hydroxyphenyl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Smiles: Oc1ccc(cc1)c1cc(=O)[nH]c(=S)[nH]1

STK066277
Synonyms: 2,5-diphenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1c(nn2c1nc(cc2C(F)(F)F)c1ccccc1)c1ccccc1

STK066306
Synonyms: 2-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrahydroisoquinoline
Smiles: c1ccc2c(c1)CN(CC2)Cc1ccc2c(c1)OCO2

STK066314
Synonyms: 1-{5-[(E)-2-(2-chlorophenyl)ethenyl]-1,3,4-thiadiazol-2-yl}-3-(4-methoxyphenyl)urea
Smiles: COc1ccc(cc1)NC(=O)Nc1nnc(s1)/C=C/c1ccccc1Cl

STK066325
Synonyms: 2-methyl-N'-[(2Z)-1,1,1-trifluoro-5,5-dimethyl-4-oxohexan-2-ylidene]furan-3-carbohydrazide
Smiles: O=C(C(C)(C)C)C/C(=N/NC(=O)c1ccoc1C)/C(F)(F)F

STK066332
Synonyms: (5E)-5-(4-{3-[4-(butan-2-yl)phenoxy]propoxy}-3-methoxybenzylidene)-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: C=CCN1C(=S)S/C(=C/c2ccc(c(c2)OC)OCCCOc2ccc(cc2)C(CC)C)/C1=O

STK066375
Synonyms: N''-{(E)-[4-(dimethylamino)phenyl]methylidene}carbonohydrazonicdiamide
Smiles: CN(c1ccc(cc1)/C=N/N=C(N)N)C

STK066405
Synonyms: N-(2-cyanoethyl)-N-(3-phenylpropyl)-2,1,3-benzothiadiazole-4-sulfonamide
Smiles: N#CCCN(S(=O)(=O)c1cccc2c1nsn2)CCCc1ccccc1

STK066407
Synonyms: [2-(6-bromo-2,1-benzoxazol-3-yl)ethyl](chloro)mercury
Smiles: Cl[Hg]CCc1onc2c1ccc(c2)Br

STK066411
Synonyms: [1-(4-ethylbenzyl)piperidin-4-yl](morpholin-4-yl)methanone
Smiles: CCc1ccc(cc1)CN1CCC(CC1)C(=O)N1CCOCC1

STK066443
Synonyms: (5Z)-2-imino-5-(4-methoxy-3-nitrobenzylidene)-1,3-thiazolidin-4-one
Smiles: COc1ccc(cc1[N+](=O)[O-])/C=C/1\SC(=N)NC1=O

STK066464
Synonyms: [(1-benzyl-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-4-yl)(4-bromophenyl)methyl]propanedinitrile
Smiles: N#CC(C(C1C(=NN(C1=O)Cc1ccccc1)C)c1ccc(cc1)Br)C#N

STK066469
Synonyms: N-{5-[(2-phenoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}acetamide
Smiles: CC(=O)Nc1nnc(s1)SCCOc1ccccc1

STK066479
Synonyms: N-(3-bromobenzyl)-N'-[3-(diethylamino)propyl]butanediamide
Smiles: CCN(CCCNC(=O)CCC(=O)NCc1cccc(c1)Br)CC

STK066496
Synonyms: N-tert-butyl-3-(4-fluorophenyl)-3-oxo-2-(2-oxopyridin-1(2H)-yl)propanamide
Smiles: O=C(C(n1ccccc1=O)C(=O)c1ccc(cc1)F)NC(C)(C)C

STK066498
Synonyms: 4-(2,4-dichlorophenoxy)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)butanamide
Smiles: O=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)CCCOc1ccc(cc1Cl)Cl

STK066505
Synonyms: 3-(octadecyloxy)phenol
Smiles: CCCCCCCCCCCCCCCCCCOc1cccc(c1)O

STK066555
Synonyms: 3-chloro-N-(3-{[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]amino}phenyl)benzamide
Smiles: COc1cccc(c1O)/C=N/c1cccc(c1)NC(=O)c1cccc(c1)Cl

STK066557
Synonyms: 3-(2-bromophenyl)-5-phenyl-1,2,4-oxadiazole
Smiles: Brc1ccccc1c1noc(n1)c1ccccc1

STK066601
Synonyms: 4-{[(E)-(5-bromo-2-hydroxyphenyl)methylidene]amino}-N-carbamimidoylbenzenesulfonamide
Smiles: NC(=N)NS(=O)(=O)c1ccc(cc1)/N=C/c1cc(Br)ccc1O

STK066611
Synonyms: 2-(3,4-dimethoxyphenyl)-6-phenylimidazo[2,1-b][1,3,4]thiadiazole
Smiles: COc1cc(ccc1OC)c1nn2c(s1)nc(c2)c1ccccc1

STK066629
Synonyms: 2-(phenylcarbonyl)-N-(4-sulfamoylphenyl)benzamide
Smiles: O=C(c1ccccc1C(=O)Nc1ccc(cc1)S(=O)(=O)N)c1ccccc1

STK066641
Synonyms: N-[3-(dimethylamino)-2,2-dimethylpropyl]-1-(2-ethoxybenzyl)piperidine-4-carboxamide
Smiles: CCOc1ccccc1CN1CCC(CC1)C(=O)NCC(CN(C)C)(C)C

STK066650
Synonyms: 5-chloro-3-methyl-1-phenyl-1H-pyrazole-4-sulfonicacid
Smiles: Cc1nn(c(c1S(=O)(=O)O)Cl)c1ccccc1

STK066704
Synonyms: 7-hydroxy-1,3-dimethyl-6-(4-propoxyphenyl)-1H-pyrrolo[3,2-d]pyrimidine-2,4(3H,5H)-dione
Smiles: CCCOc1ccc(cc1)c1[nH]c2c(c1O)n(C)c(=O)n(c2=O)C

STK066739
Synonyms: 2-(pyridin-3-yl)piperidin-1-amine
Smiles: NN1CCCCC1c1cccnc1

STK066767
Synonyms: ethyl1-(3-ethoxypropyl)-5-hydroxy-2-methyl-1H-benzo[g]indole-3-carboxylate
Smiles: CCOCCCn1c2c(c(c1C)C(=O)OCC)cc(c1c2cccc1)O

STK066775
Synonyms: N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}-2-(methylamino)benzamide
Smiles: CNc1ccccc1C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nc(C)cc(n1)C

STK066788
Synonyms: 1-{4-[2-hydroxy-3-(piperidin-1-yl)propoxy]-3-methoxyphenyl}propan-1-ol
Smiles: CCC(c1ccc(c(c1)OC)OCC(CN1CCCCC1)O)O

STK066799
Synonyms: 5,5-dimethyl-2-[(1-phenylethyl)amino]cyclohex-2-en-1-one
Smiles: O=C1CC(C)(C)CC=C1NC(c1ccccc1)C

STK066826
Synonyms: 5-[(Z)-(3-carboxy-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)(2,6-dichloro-3-sulfophenyl)methyl]-2-hydroxy-3-methylbenzoicacid
Smiles: CC1=C/C(=C(/c2c(Cl)ccc(c2Cl)S(=O)(=O)O)\c2cc(C)c(c(c2)C(=O)O)O)/C=C(C1=O)C(=O)O

STK066849
Synonyms: 1-[2-(5-chloro-2-oxopyridin-1(2H)-yl)-3-oxo-3-phenylpropanoyl]-N-(4-methoxybenzyl)piperidine-4-carboxamide
Smiles: COc1ccc(cc1)CNC(=O)C1CCN(CC1)C(=O)C(n1cc(Cl)ccc1=O)C(=O)c1ccccc1

STK066869
Synonyms: 2-(4-ethylbenzylidene)-1H-indene-1,3(2H)-dione
Smiles: CCc1ccc(cc1)/C=C/1\C(=O)c2c(C1=O)cccc2

STK066876
Synonyms: N-(2-hydroxyethyl)piperidine-4-carboxamide
Smiles: OCCNC(=O)C1CCNCC1

STK066889
Synonyms: 4'-ethylbiphenyl-4-ylpropylether
Smiles: CCCOc1ccc(cc1)c1ccc(cc1)CC

STK066910
Synonyms: (6Z)-6-{3-chloro-5-methoxy-4-[2-(4-methylphenoxy)ethoxy]benzylidene}-5-imino-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1cc(cc(c1OCCOc1ccc(cc1)C)Cl)/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1

STK066930
Synonyms: 2,4-dibromo-6-[(E)-({4-[(4,6-diphenylpyrimidin-2-yl)amino]phenyl}imino)methyl]phenol
Smiles: Brc1cc(/C=N/c2ccc(cc2)Nc2nc(cc(n2)c2ccccc2)c2ccccc2)c(c(c1)Br)O

STK066940
Synonyms: 6-bromo-4,8-dimethyl-2-(methylamino)pyrido[2,3-d]pyrimidin-7(8H)-one
Smiles: CNc1nc(C)c2c(n1)n(C)c(=O)c(c2)Br

STK066963
Synonyms: 2-tert-butyl-5-(2-hydroxybenzylidene)-2-methyl-1,3-dioxane-4,6-dione
Smiles: O=C1OC(C)(OC(=O)/C/1=C\c1ccccc1O)C(C)(C)C

STK066976
Synonyms: N-(3,5-dibromopyridin-2-yl)formamide
Smiles: O=CNc1ncc(cc1Br)Br

STK066983
Synonyms: methylN-{4-[(4-fluorobenzyl)amino]-4-oxobutanoyl}leucinate
Smiles: COC(=O)C(NC(=O)CCC(=O)NCc1ccc(cc1)F)CC(C)C

STK066992
Synonyms: 3-[4-(difluoromethoxy)phenyl]-5-(4-propylcyclohexyl)-1,2,4-oxadiazole
Smiles: CCCC1CCC(CC1)c1onc(n1)c1ccc(cc1)OC(F)F

STK067015
Synonyms: 1-{5-[(3,4-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-(3,4-dimethylphenyl)urea
Smiles: O=C(Nc1ccc(c(c1)C)C)Nc1nnc(s1)COc1ccc(c(c1)C)C

STK067028
Synonyms: 1H-benzimidazol-1-yl(4-chloro-2-nitrophenyl)methanone
Smiles: Clc1ccc(c(c1)[N+](=O)[O-])C(=O)n1cnc2c1cccc2

STK067036
Synonyms: N-(2-ethylhexyl)-N'-[3-(morpholin-4-yl)propyl]butanediamide
Smiles: CCCCC(CNC(=O)CCC(=O)NCCCN1CCOCC1)CC

STK067062
Synonyms: 4-(acetylamino)-N-[4-(dimethylamino)phenyl]benzamide
Smiles: CC(=O)Nc1ccc(cc1)C(=O)Nc1ccc(cc1)N(C)C

STK067067
Synonyms: 2-(1,3-benzothiazol-2-yl)-N-(4,6-dimethylpyrimidin-2-yl)hydrazinecarboximidamide
Smiles: N=C(Nc1nc(C)cc(n1)C)NNc1nc2c(s1)cccc2

STK067104
Synonyms: N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-4-fluorobenzenesulfonamide
Smiles: Fc1ccc(cc1)S(=O)(=O)Nc1nnc(s1)C1CCCCC1

STK067121
Synonyms: 6-[(2E)-2-{4-[2-(4-tert-butylphenoxy)ethoxy]-3-ethoxybenzylidene}hydrazinyl]-N,N-dimethyl-2-(propan-2-yl)pyrimidin-4-amine
Smiles: CCOc1cc(/C=N/Nc2nc(nc(c2)N(C)C)C(C)C)ccc1OCCOc1ccc(cc1)C(C)(C)C

STK067129
Synonyms: 3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-(1-phenylethyl)-2,3-dihydro-1H-isoindol-1-one
Smiles: COc1ccc(cc1OC)CCNC1N(C(=O)c2c1cccc2)C(c1ccccc1)C

STK067132
Synonyms: 2-[(4-amino-6-hydroxypyrimidin-2-yl)sulfanyl]-1-(2,4,6-trimethylphenyl)ethanone
Smiles: Cc1cc(C)c(c(c1)C)C(=O)CSc1nc(N)cc(n1)O

STK067138
Synonyms: 4-[(4Z)-3-methyl-5-oxo-4-{[5-(4-sulfamoylphenyl)furan-2-yl]methylidene}-4,5-dihydro-1H-pyrazol-1-yl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)N1N=C(/C(=C/c2ccc(o2)c2ccc(cc2)S(=O)(=O)N)/C1=O)C

STK067143
Synonyms: 1-[(2,5-dimethylphenyl)sulfonyl]-5-nitro-1H-benzimidazole
Smiles: Cc1ccc(c(c1)S(=O)(=O)n1cnc2c1ccc(c2)[N+](=O)[O-])C

STK067151
Synonyms: 7,9-dimethyl-11-phenylpyrimido[4',5':3,4]pyrrolo[2,1-c][1,2,4]benzotriazine-8,10(7H,9H)-dione
Smiles: O=c1n(C)c(=O)n(c2c1c(c1ccccc1)n1c2nnc2c1cccc2)C

STK067152
Synonyms: (3Z)-3-(2-carbamoylhydrazinylidene)-1-phenylcyclopentanecarboxylicacid
Smiles: NC(=O)N/N=C\1/CCC(C1)(C(=O)O)c1ccccc1

STK067177
Synonyms: naphtho[2'',3'':4',5'][1,3]thiazolo[3',2':2,3][1,2,4]triazino[5,6-b]indole-8,13-dione
Smiles: O=C1c2ccccc2C(=O)c2c1sc1n2nc2c(n1)nc1c2cccc1

STK067207
Synonyms: 1H-benzimidazol-1-yl(biphenyl-4-yl)methanone
Smiles: O=C(n1cnc2c1cccc2)c1ccc(cc1)c1ccccc1

STK067217
Synonyms: 1-tert-butyl-4-[(1E)-2-ethylbuta-1,3-dien-1-yl]benzenehydrate
Smiles: CC/C(=C\c1ccc(cc1)C(C)(C)C)/C=C.O

STK067237
Synonyms: 2-(4-bromo-2-methylphenoxy)-N'-[(2-nitrophenyl)sulfonyl]acetohydrazide
Smiles: O=C(NNS(=O)(=O)c1ccccc1[N+](=O)[O-])COc1ccc(cc1C)Br

STK067248
Synonyms: 5-(2-bromophenyl)-3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazole
Smiles: COc1cc(cc(c1OC)OC)c1noc(n1)c1ccccc1Br

STK067266
Synonyms: (1E)-1-[(2E)-1-(4-bromophenyl)-3-(4-methoxyphenyl)prop-2-en-1-ylidene]-2-(2,4-dinitrophenyl)hydrazine
Smiles: COc1ccc(cc1)/C=C/C(=N\Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/c1ccc(cc1)Br

STK067292
Synonyms: N-(1-hydroxy-2-methylpropan-2-yl)-1-(naphthalen-1-ylmethyl)piperidine-4-carboxamide
Smiles: OCC(NC(=O)C1CCN(CC1)Cc1cccc2c1cccc2)(C)C

STK067300
Synonyms: (4-tert-butylphenyl)(5,6-dimethyl-1H-benzimidazol-1-yl)methanone
Smiles: Cc1cc2ncn(c2cc1C)C(=O)c1ccc(cc1)C(C)(C)C

STK067314
Synonyms: 3-amino-2,6-dimethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CC1CCc2c(C1)c1c(s2)nc(n(c1=O)N)C

STK067348
Synonyms:
Smiles: CCOC(=O)C1C(=[S]C2=C1CCCC2)NC(=O)C(Sc1nc(C)cc(n1)C)CC

STK067365
Synonyms: 2-(3-bromophenyl)-2-oxoethylN'-cyano-N-methylcarbamimidothioate
Smiles: N#C/N=C(/SCC(=O)c1cccc(c1)Br)\NC

STK067370
Synonyms: 5-ethyl-5-methyl-2-phenyl-2,5-dihydro-1H-pyrazole-3-thiol
Smiles: CCC1(C)NN(C(=C1)S)c1ccccc1

STK067372
Synonyms: N-(1-acetyl-2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-2-methyl-N-phenylpropanamide
Smiles: CC(C(=O)N(C1CC(C)N(c2c1cccc2)C(=O)C)c1ccccc1)C

STK067396
Synonyms: 3,5-dimethyl-N-(3-methylphenyl)-1H-pyrazole-1-carbothioamide
Smiles: Cc1cccc(c1)NC(=S)n1nc(cc1C)C

STK067399
Synonyms: 5a,6,7,8,9,10-hexahydroazepino[2,1-b]quinazolin-12(5H)-one
Smiles: O=C1N2CCCCCC2Nc2c1cccc2

STK067420
Synonyms: (4-bromophenyl){2,8-dimethyl-4-[(2-methylphenyl)amino]-3,4-dihydroquinolin-1(2H)-yl}methanone
Smiles: Brc1ccc(cc1)C(=O)N1C(C)CC(c2c1c(C)ccc2)Nc1ccccc1C

STK067456
Synonyms: 4-(4-chlorophenyl)-2-sulfanyl-6-(thiophen-2-yl)pyridine-3-carbonitrile
Smiles: N#Cc1c(S)nc(cc1c1ccc(cc1)Cl)c1cccs1

STK067477
Synonyms: 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N'-[(1E)-1-(4-nitrophenyl)ethylidene]acetohydrazide
Smiles: O=C(Cn1cnc2c1c(=O)n(C)c(=O)n2C)N/N=C(/c1ccc(cc1)[N+](=O)[O-])\C

STK067512
Synonyms: N'-[(1E)-1-(6,8-dibromo-2-oxo-2H-chromen-3-yl)ethylidene]pyridine-3-carbohydrazide
Smiles: Brc1cc(Br)c2c(c1)cc(c(=O)o2)/C(=N/NC(=O)c1cccnc1)/C

STK067518
Synonyms: N-[2-(2-fluorophenyl)-1,3-benzoxazol-5-yl]-3-nitrobenzamide
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])Nc1ccc2c(c1)nc(o2)c1ccccc1F

STK067523
Synonyms: 1-(3,5-dimethoxyphenyl)-3-morpholin-4-ylthiourea
Smiles: COc1cc(NC(=S)NN2CCOCC2)cc(c1)OC

STK067543
Synonyms: N-[5-(2-{(2E)-2-[4-(dimethylamino)benzylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]-4-methylbenzamide
Smiles: O=C(Cc1nnc(s1)NC(=O)c1ccc(cc1)C)N/N=C/c1ccc(cc1)N(C)C

STK067616
Synonyms: 3-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]benzenesulfonate
Smiles: Clc1nc(Nc2cccc(c2)S(=O)(=O)[O-])nc(n1)Cl

STK067622
Synonyms: 2-(4-bromophenyl)-2-oxoethylformate
Smiles: O=COCC(=O)c1ccc(cc1)Br

STK067626
Synonyms: 4-({4-[(E)-(hydroxyimino)methyl]phenoxy}methyl)benzoicacid
Smiles: O/N=C/c1ccc(cc1)OCc1ccc(cc1)C(=O)O

STK067636
Synonyms: potassium4-{(E)-[(2-hydroxyethyl)sulfanyl]diazenyl}benzoate
Smiles: OCCS/N=N/c1ccc(cc1)C(=O)[O-].[K+]

STK067638
Synonyms: 3-{[(E)-(2-chloro-5-nitrophenyl)methylidene]amino}phenol
Smiles: Oc1cccc(c1)/N=C/c1cc(ccc1Cl)[N+](=O)[O-]

STK067647
Synonyms: 2-{3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}-1,3-thiazolidine-4-carboxylicacid
Smiles: COc1ccc(cc1Cn1nc(c(c1C)[N+](=O)[O-])C)C1SCC(N1)C(=O)O

STK067683
Synonyms: pyridin-2-yl2-chlorobenzoate
Smiles: O=C(c1ccccc1Cl)Oc1ccccn1

STK067684
Synonyms: ethyl4'-(propanoylamino)-1'H-spiro[cyclopentane-1,2'-naphthalene]-3'-carboxylate
Smiles: CCOC(=O)C1=C(NC(=O)CC)c2ccccc2CC21CCCC2

STK067710
Synonyms: 3-(2-chlorophenyl)-5-(4-hexylphenyl)-1,2,4-oxadiazole
Smiles: CCCCCCc1ccc(cc1)c1onc(n1)c1ccccc1Cl

STK067711
Synonyms: 2,3-dichloro-5-ethoxy-6-hydroxybenzaldehyde
Smiles: CCOc1cc(Cl)c(c(c1O)C=O)Cl

STK067718
Synonyms: 4-(propan-2-yloxy)-N-{[2-(2,4,6-trichlorophenyl)hydrazinyl]carbonothioyl}benzamide
Smiles: CC(Oc1ccc(cc1)C(=O)NC(=S)NNc1c(Cl)cc(cc1Cl)Cl)C

STK067721
Synonyms: 3-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]pyridine
Smiles: n1ccc(cc1)c1noc(n1)c1cccnc1

STK067725
Synonyms: N,N-diethyl-N'-(4-nitrophenyl)butanediamide
Smiles: CCN(C(=O)CCC(=O)Nc1ccc(cc1)[N+](=O)[O-])CC

STK067727
Synonyms: 2,5-dimethylhexane-2,5-diol
Smiles: CC(CCC(O)(C)C)(O)C

STK067736
Synonyms: 6-chloro-2-methyl-5-(prop-2-en-1-yl)pyrimidin-4-amine
Smiles: C=CCc1c(N)nc(nc1Cl)C

STK067763
Synonyms: 1-(3,5-dimethyl-1H-pyrazol-1-yl)-2-(3-methylphenoxy)ethanone
Smiles: Cc1cccc(c1)OCC(=O)n1nc(cc1C)C

STK067768
Synonyms: N-(2-hydroxyethyl)-1-[3-oxo-2-(2-oxopyridin-1(2H)-yl)-3-phenylpropanoyl]piperidine-4-carboxamide
Smiles: OCCNC(=O)C1CCN(CC1)C(=O)C(n1ccccc1=O)C(=O)c1ccccc1

STK067794
Synonyms: (6Z)-3-(benzylsulfanyl)-6-(3-bromo-4-hydroxybenzylidene)-5-imino-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
Smiles: O=C1N=c2snc(n2C(=N)/C/1=C/c1ccc(c(c1)Br)O)SCc1ccccc1

STK067805
Synonyms: 5-bromo-1-methyl-3-(1H-pyrrol-2-yl)-1H-indole
Smiles: Brc1ccc2c(c1)c(cn2C)c1ccc[nH]1

STK067816
Synonyms: 1-(4-bromobenzyl)piperidine-4-carboxylicacid
Smiles: OC(=O)C1CCN(CC1)Cc1ccc(cc1)Br

STK067834
Synonyms: 4-methyl-3-{5-[(E)-(2-{[3-(trifluoromethyl)phenyl]acetyl}hydrazinylidene)methyl]furan-2-yl}benzoicacid
Smiles: O=C(Cc1cccc(c1)C(F)(F)F)N/N=C/c1ccc(o1)c1cc(ccc1C)C(=O)O

STK067840
Synonyms: 2-[(2E)-2-(3-chloro-4-methoxybenzylidene)hydrazinyl]-5-nitropyridine
Smiles: COc1ccc(cc1Cl)/C=N/Nc1ccc(cn1)[N+](=O)[O-]

STK067843
Synonyms: N-benzyl-1-[3-(4-fluorophenyl)-3-oxo-2-(2-oxopyridin-1(2H)-yl)propanoyl]-N-methylpiperidine-4-carboxamide
Smiles: Fc1ccc(cc1)C(=O)C(n1ccccc1=O)C(=O)N1CCC(CC1)C(=O)N(Cc1ccccc1)C

STK067852
Synonyms: N'-[3-oxo-2-(tetrahydrofuran-2-ylmethyl)-2,3-dihydro-1H-isoindol-1-yl]benzohydrazide
Smiles: O=C(c1ccccc1)NNC1N(CC2CCCO2)C(=O)c2c1cccc2

STK067860
Synonyms: 5-(4-nitrophenyl)-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole
Smiles: [O-][N+](=O)c1ccc(cc1)c1onc(n1)c1cccc(c1)C(F)(F)F

STK067885
Synonyms: (1E)-N-hydroxy-1-(2-methyl-1H-indol-3-yl)-2-phenylethanimine
Smiles: O/N=C(/c1c(C)[nH]c2c1cccc2)\Cc1ccccc1

STK067909
Synonyms: ethyl2-{[(2-iodophenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccccc2I)sc2c1CCCC2

STK067927
Synonyms: 5-{[5-(4-chloro-3-nitrophenyl)furan-2-yl]methylidene}-2-phenyl-1,3-dioxane-4,6-dione
Smiles: O=C1OC(OC(=O)/C/1=C\c1ccc(o1)c1ccc(c(c1)[N+](=O)[O-])Cl)c1ccccc1

STK067936
Synonyms: (10Z)-7-(3,4-dimethoxyphenyl)-10-(4-hydroxy-3-iodo-5-nitrobenzylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Smiles: COc1ccc(cc1OC)C1C2=C(N=c3n1c(=O)/c(=C/c1cc(I)c(c(c1)[N+](=O)[O-])O)/s3)c1c(CC2)cccc1

STK067946
Synonyms: N-(1-acetyl-2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylpentanamide
Smiles: CCCCC(=O)N(C1CC(C)N(c2c1cccc2)C(=O)C)c1ccccc1

STK067962
Synonyms: N-[(2Z)-8-methoxy-3-(4-phenyl-1,3-thiazol-2-yl)-2H-chromen-2-ylidene]-1,3-thiazol-2-amine
Smiles: COc1cccc2c1o/c(=N\c1nccs1)/c(c2)c1scc(n1)c1ccccc1

STK067975
Synonyms: 2-(5-chloro-2-oxopyridin-1(2H)-yl)-N-(furan-2-ylmethyl)-3-(3-nitrophenyl)-3-oxopropanamide
Smiles: Clc1ccc(=O)n(c1)C(C(=O)c1cccc(c1)[N+](=O)[O-])C(=O)NCc1ccco1

STK068019
Synonyms: 2-(5-{[(2,4-dichlorophenyl)carbamoyl]amino}-1,3,4-thiadiazol-2-yl)-N-(2-methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)Nc1nnc(s1)CC(=O)Nc1ccccc1C

STK068026
Synonyms: 4'-methoxy-N'-[(4-nitrophenyl)carbonyl]biphenyl-4-carbohydrazide
Smiles: COc1ccc(cc1)c1ccc(cc1)C(=O)NNC(=O)c1ccc(cc1)[N+](=O)[O-]

STK068027
Synonyms: 2-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-6-bromo-7-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Smiles: Nc1nnc(s1)SCc1nn2c(s1)nc(c(c2=O)Br)C

STK068029
Synonyms: [4-(4-chloro-2-nitrophenyl)piperazin-1-yl](3-ethoxyphenyl)methanone
Smiles: CCOc1cccc(c1)C(=O)N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])Cl

STK068030
Synonyms: (6Z)-6-{3-bromo-5-methoxy-4-[2-(4-methylphenoxy)ethoxy]benzylidene}-5-imino-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1cc(cc(c1OCCOc1ccc(cc1)C)Br)/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1

STK068046
Synonyms: N-(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl)acetamide
Smiles: CC(=O)Nn1cc2c(c1)c(=O)n(c(=O)n2C)C

STK068051
Synonyms: dimethyl1-benzyl-4-[4-(methylsulfanyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate
Smiles: COC(=O)C1=CN(C=C(C1c1ccc(cc1)SC)C(=O)OC)Cc1ccccc1

STK068056
Synonyms: 1-(2,6-dimethyl-4-oxopyridin-1(4H)-yl)thiourea
Smiles: NC(=S)Nn1c(C)cc(=O)cc1C

STK068084
Synonyms: N'-[(2E)-4-(morpholin-4-yl)-4-oxobut-2-enoyl]pyridine-2-carbohydrazide
Smiles: O=C(NNC(=O)c1ccccn1)/C=C/C(=O)N1CCOCC1

STK068095
Synonyms: 4'-methylbiphenyl-4-carboxylicacid
Smiles: Cc1ccc(cc1)c1ccc(cc1)C(=O)O

STK068124
Synonyms: 6-chloro-3-{[5-(3,5-dimethoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-4-phenylquinolin-2(1H)-one
Smiles: C=CCn1c(nnc1c1cc(OC)cc(c1)OC)Sc1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Cl

STK068130
Synonyms: N'-[(1Z)-1-(2,5-dihydroxyphenyl)ethylidene]-2-methoxybenzohydrazide
Smiles: COc1ccccc1C(=O)N/N=C(\c1cc(O)ccc1O)/C

STK068143
Synonyms: 4-methyl-N-{2-[4-(prop-1-en-2-yl)phenyl]propan-2-yl}piperazine-1-carboxamide
Smiles: CN1CCN(CC1)C(=O)NC(c1ccc(cc1)C(=C)C)(C)C

STK068171
Synonyms: 3-[(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]-N-(2-methoxyphenyl)-4-(morpholin-4-yl)benzenesulfonamide
Smiles: COc1ccccc1NS(=O)(=O)c1ccc(c(c1)NC1=C(Cl)C(=O)c2c(C1=O)cccc2)N1CCOCC1

STK068195
Synonyms: 1-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-(2-methoxyphenyl)urea
Smiles: COc1cc(ccc1OC)c1nnc(s1)NC(=O)Nc1ccccc1OC

STK068200
Synonyms: 2-[(1-amino-5-methyl-1H-imidazol-2-yl)sulfanyl]-6-bromo-7-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Smiles: Cc1cnc(n1N)Sc1sc2n(n1)c(=O)c(c(n2)C)Br

STK068212
Synonyms: ethyl(2Z)-2-(2-hydroxybenzylidene)-7-methyl-3-oxo-5-[2-(propan-2-yloxy)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1OC(C)C)c(=O)/c(=C/c1ccccc1O)/s2

STK068222
Synonyms: 2-(2-chloro-4-methylphenoxy)-N-[(2-hydroxy-4-methylphenyl)carbamothioyl]acetamide
Smiles: O=C(NC(=S)Nc1ccc(cc1O)C)COc1ccc(cc1Cl)C

STK068225
Synonyms: 4-hydroxy-N-(3-methoxyphenyl)-1-(2-methylpropyl)-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: COc1cccc(c1)NC(=O)c1c(O)c2ccccc2n(c1=O)CC(C)C

STK068300
Synonyms: 2-[(4-phenylpiperazin-1-yl)methyl]phenol
Smiles: Oc1ccccc1CN1CCN(CC1)c1ccccc1

STK068319
Synonyms: N-{5-[(6-ethyl-7-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}acetamide
Smiles: CCc1c(C)nc2n(c1=O)nc(s2)Sc1nnc(s1)NC(=O)C

STK068325
Synonyms: 3-phenyl-2-[2-(piperidin-1-yl)ethyl]quinazolin-4(3H)-one
Smiles: O=c1n(c2ccccc2)c(CCN2CCCCC2)nc2c1cccc2

STK068336
Synonyms: 2-(dimethylamino)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-carboxamide
Smiles: CN(c1nc2CC(C)(C)OCc2cc1C(=O)N)C

STK068347
Synonyms: acridin-10(9H)-yl(phenyl)methanone
Smiles: O=C(N1c2ccccc2Cc2c1cccc2)c1ccccc1

STK068350
Synonyms: 2-(acetylamino)phenyl4-butoxybenzoate
Smiles: CCCCOc1ccc(cc1)C(=O)Oc1ccccc1NC(=O)C

STK068371
Synonyms: 5-oxo-N-phenyl-1-[4-(propan-2-yl)phenyl]pyrrolidine-3-carboxamide
Smiles: CC(c1ccc(cc1)N1CC(CC1=O)C(=O)Nc1ccccc1)C

STK068393
Synonyms: [4-(4-bromophenyl)-2-(4-nitrophenyl)-1,3-thiazol-5-yl]aceticacid
Smiles: OC(=O)Cc1sc(nc1c1ccc(cc1)Br)c1ccc(cc1)[N+](=O)[O-]

STK068428
Synonyms: (10Z)-10-{[5-(4-acetylphenyl)furan-2-yl]methylidene}-7-[4-(methylsulfanyl)phenyl]-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Smiles: CSc1ccc(cc1)C1C2=C(N=c3n1c(=O)/c(=C/c1ccc(o1)c1ccc(cc1)C(=O)C)/s3)c1c(CC2)cccc1

STK068438
Synonyms: 2-(4-bromophenyl)-5-[4-(4-propylcyclohexyl)phenyl]-1,3,4-oxadiazole
Smiles: CCCC1CCC(CC1)c1ccc(cc1)c1nnc(o1)c1ccc(cc1)Br

STK068449
Synonyms: N-[(2,4-dimethylphenyl)carbamothioyl]-3,4-dimethylbenzamide
Smiles: S=C(Nc1ccc(cc1C)C)NC(=O)c1ccc(c(c1)C)C

STK068461
Synonyms: 3-methyl-3-{2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl}-8-[(2-methylpropoxy)methyl]-2,7-dioxaspiro[4.4]nonane-1,6-dione
Smiles: CC(COCC1OC(=O)C2(C1)CC(OC2=O)(C)c1csc(n1)Nc1ccc(cc1)C)C

STK068475
Synonyms:
Smiles: COc1ccc(cc1Cn1[nH]c(c(c1C)[N+](=O)[O-])C)/C=N/n1c[nH]nc1

STK068482
Synonyms: 2-cyano-N'-(5,7-dinitroquinolin-8-yl)acetohydrazide
Smiles: N#CCC(=O)NNc1c(cc(c2c1nccc2)[N+](=O)[O-])[N+](=O)[O-]

STK068495
Synonyms: 7-hydroxy-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-oxo-2H-chromene-3-carboxamide
Smiles: Cc1ccc(cc1)c1csc(n1)NC(=O)c1cc2ccc(cc2oc1=O)O

STK068496
Synonyms: N-(2-chlorobenzyl)-1-(2-hydroxy-3-methoxybenzyl)piperidine-4-carboxamide
Smiles: COc1cccc(c1O)CN1CCC(CC1)C(=O)NCc1ccccc1Cl

STK068504
Synonyms: 4-{(E)-[(2-cyanophenyl)imino]methyl}-2-methoxyphenylacetate
Smiles: COc1cc(/C=N/c2ccccc2C#N)ccc1OC(=O)C

STK068507
Synonyms: 4-chloro-N-{4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl}benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)S(=O)(=O)Nc1c(C)cc(cc1C)C

STK068532
Synonyms: (2Z)-N-[4-(4-butoxyphenyl)-1,3-thiazol-2-yl]-6-chloro-2-[(2,3-dimethylphenyl)imino]-2H-chromene-3-carboxamide
Smiles: CCCCOc1ccc(cc1)c1csc(n1)NC(=O)c1cc2cc(Cl)ccc2o/c/1=N\c1cccc(c1C)C

STK068580
Synonyms: 2-[(acetylcarbamothioyl)amino]benzoicacid
Smiles: CC(=O)NC(=S)Nc1ccccc1C(=O)O

STK068582
Synonyms: 2-benzyl-3-methylquinoline-4-carboxylicacid
Smiles: OC(=O)c1c(C)c(Cc2ccccc2)nc2c1cccc2

STK068597
Synonyms: (piperidin-1-ylmethyl)phosphonicacid
Smiles: OP(=O)(CN1CCCCC1)O

STK068604
Synonyms: 3-{[(E)-(4-chloro-3-nitrophenyl)methylidene]amino}phenol
Smiles: Oc1cccc(c1)/N=C/c1ccc(c(c1)[N+](=O)[O-])Cl

STK068654
Synonyms: 1-{3-methoxy-4-[2-oxo-2-(pyrrolidin-1-yl)ethoxy]phenyl}propan-1-one
Smiles: CCC(=O)c1ccc(c(c1)OC)OCC(=O)N1CCCC1

STK068655
Synonyms: 3-methyl-5-[(pentyloxy)methyl]-4,5-dihydro-1H-furo[2,3-c]pyrazole-1-carboxamide
Smiles: CCCCCOCC1Cc2c(O1)n(nc2C)C(=O)N

STK068661
Synonyms: 2-[(2,6-difluorophenyl)carbonyl]cyclohexanone
Smiles: O=C1CCCCC1C(=O)c1c(F)cccc1F

STK068664
Synonyms: (4E)-4-[3-chloro-5-methoxy-4-(naphthalen-1-ylmethoxy)benzylidene]-1-phenylpyrazolidine-3,5-dione
Smiles: COc1cc(/C=C/2\C(=O)NN(C2=O)c2ccccc2)cc(c1OCc1cccc2c1cccc2)Cl

STK068682
Synonyms: 4-tert-butyl-2-chloro-6-{[(E)-(3-ethoxy-2-hydroxyphenyl)methylidene]amino}phenol
Smiles: CCOc1cccc(c1O)/C=N/c1cc(cc(c1O)Cl)C(C)(C)C

STK068687
Synonyms: 5-({1-[2-(4-chloro-3-methylphenoxy)ethyl]-2-methyl-1H-indol-3-yl}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)C(=Cc2c(C)n(c3c2cccc3)CCOc2ccc(c(c2)C)Cl)C(=O)N1

STK068718
Synonyms: (5E)-5-{4-[(4-chlorobenzyl)oxy]-3-ethoxy-5-[(1E)-prop-1-en-1-yl]benzylidene}-1-(4-ethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCOc1cc(/C=C/2\C(=O)NC(=O)N(C2=O)c2ccc(cc2)OCC)cc(c1OCc1ccc(cc1)Cl)/C=C/C

STK068724
Synonyms: 1-(3-{[(E)-naphthalen-1-ylmethylidene]amino}phenyl)ethanone
Smiles: CC(=O)c1cccc(c1)/N=C/c1cccc2c1cccc2

STK068737
Synonyms: (6Z)-5-imino-6-{3-methoxy-4-[(2-methylbenzyl)oxy]benzylidene}-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1cc(ccc1OCc1ccccc1C)/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1

STK068742
Synonyms: 8-(dodecylsulfanyl)-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCSc1nc2c(n1CC(COc1ccccc1)O)c(=O)[nH]c(=O)n2C

STK068750
Synonyms: N-[2-chloro-5-(trifluoromethyl)phenyl]-3-nitrobenzenesulfonamide
Smiles: Clc1ccc(cc1NS(=O)(=O)c1cccc(c1)[N+](=O)[O-])C(F)(F)F

STK068752
Synonyms: (3E)-5-(4-chlorophenyl)-3-[3-methoxy-4-(propan-2-yloxy)benzylidene]furan-2(3H)-one
Smiles: COc1cc(ccc1OC(C)C)/C=C/1\C=C(OC1=O)c1ccc(cc1)Cl

STK068756
Synonyms: 2-(4-chlorophenyl)-2-oxoethyl[(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]acetate
Smiles: N#Cc1c(SCC(=O)OCC(=O)c2ccc(cc2)Cl)nc(c2c1CCCC2)C

STK068767
Synonyms: 4-{[(E)-(2,4-dihydroxyphenyl)methylidene]amino}-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide
Smiles: COc1nc(OC)nc(c1)NS(=O)(=O)c1ccc(cc1)/N=C/c1ccc(cc1O)O

STK068820
Synonyms: N-(4-{[(4-chloro-2-methylphenoxy)acetyl]amino}phenyl)thiophene-2-carboxamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)c1cccs1)COc1ccc(cc1C)Cl

STK068841
Synonyms: 4-(octan-3-ylamino)-4-oxobutanoicacid
Smiles: CCCCCC(NC(=O)CCC(=O)O)CC

STK068890
Synonyms: 2-[(2E)-2-(4-ethoxybenzylidene)hydrazinyl]quinoline
Smiles: CCOc1ccc(cc1)/C=N/Nc1ccc2c(n1)cccc2

STK068911
Synonyms: N'-(diphenylmethylidene)-3-fluorobenzohydrazide
Smiles: Fc1cccc(c1)C(=O)N/N=C(/c1ccccc1)\c1ccccc1

STK068920
Synonyms: N-(3-ethoxypropyl)-1-[(5-methylfuran-2-yl)methyl]piperidine-4-carboxamide
Smiles: CCOCCCNC(=O)C1CCN(CC1)Cc1ccc(o1)C

STK068932
Synonyms: 2-[(2-fluorobenzyl)sulfanyl]-5-[(5,6,7,8-tetrahydronaphthalen-2-yloxy)methyl]-1,3,4-oxadiazole
Smiles: Fc1ccccc1CSc1nnc(o1)COc1ccc2c(c1)CCCC2

STK068938
Synonyms: methyl6-amino-5-cyano-2-(2-methoxy-2-oxoethyl)-4-(thiophen-2-yl)-4H-pyran-3-carboxylate
Smiles: COC(=O)C1=C(CC(=O)OC)OC(=C(C1c1cccs1)C#N)N

STK068994
Synonyms: 2-(1,3-benzodioxol-5-yl)-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4-ol
Smiles: OC1=NC(Nc2c1c1CCCCc1s2)c1ccc2c(c1)OCO2

STK069004
Synonyms: 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N'-[(1E)-1-phenylethylidene]acetohydrazide
Smiles: O=C(Cn1cnc2c1c(=O)n(C)c(=O)n2C)N/N=C(/c1ccccc1)\C

STK069013
Synonyms: N'-{[(4-fluorophenyl)carbonyl]oxy}pyridine-2-carboximidamide
Smiles: Fc1ccc(cc1)C(=O)O/N=C(/c1ccccn1)\N

STK069053
Synonyms: 4-(dimethylamino)-N-(2-ethoxyphenyl)benzamide
Smiles: CCOc1ccccc1NC(=O)c1ccc(cc1)N(C)C

STK069072
Synonyms: N-(tetrahydro-2H-pyran-4-yl)-2-(trifluoromethyl)-10H-phenothiazine-10-carboxamide
Smiles: O=C(N1c2ccccc2Sc2c1cc(cc2)C(F)(F)F)NC1CCOCC1

STK069073
Synonyms: 5-{[(3-fluorophenyl)carbonyl]amino}-N-methyl-1-phenyl-1H-pyrazole-4-carboxamide
Smiles: CNC(=O)c1cnn(c1NC(=O)c1cccc(c1)F)c1ccccc1

STK069083
Synonyms: 7-(4-chlorobenzyl)-8-(2,5-dichlorophenoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(cc1)Cn1c(Oc2cc(Cl)ccc2Cl)nc2c1c(=O)n(C)c(=O)n2C

STK069097
Synonyms: N-(furan-2-ylmethyl)-4-oxo-4-(piperidin-1-yl)butanamide
Smiles: O=C(NCc1ccco1)CCC(=O)N1CCCCC1

STK069102
Synonyms: ethyl{3-[(7,9-dioxo-6,10-dioxaspiro[4.5]dec-8-ylidene)methyl]-1H-indol-1-yl}acetate
Smiles: CCOC(=O)Cn1cc(c2c1cccc2)C=C1C(=O)OC2(OC1=O)CCCC2

STK069111
Synonyms: 2-[(E)-{[2-(3-methylphenyl)-1,3-benzoxazol-5-yl]imino}methyl]-4-{(E)-[3-(trifluoromethyl)phenyl]diazenyl}phenol
Smiles: Cc1cccc(c1)c1nc2c(o1)ccc(c2)/N=C/c1cc(/N=N/c2cccc(c2)C(F)(F)F)ccc1O

STK069112
Synonyms: 2-(2-bromo-4-nitrophenoxy)-N'-[(E)-(1-methyl-1H-indol-3-yl)methylidene]acetohydrazide
Smiles: O=C(COc1ccc(cc1Br)[N+](=O)[O-])N/N=C/c1cn(c2c1cccc2)C

STK069121
Synonyms: 2-[(4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(2,4,6-trimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cc(cc1C)C)CSc1nc2ccccc2c(=O)n1c1ccccc1

STK069125
Synonyms: [2-(4-methoxyphenyl)-1,3-oxazolidine-4,4-diyl]dimethanol
Smiles: OCC1(CO)COC(N1)c1ccc(cc1)OC

STK069150
Synonyms: (3Z)-3-({[(4-chlorophenyl)carbamoyl]oxy}imino)-1,3-dihydro-2H-indol-2-one
Smiles: O=C(Nc1ccc(cc1)Cl)O/N=C/1\C(=O)Nc2c1cccc2

STK069156
Synonyms: 4-[(5-bromo-6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)sulfanyl]phenol
Smiles: Oc1ccc(cc1)Sc1nn2c(s1)nc(c2Br)C

STK069171
Synonyms: 1-ethyl-3-[(4-methylphenyl)carbonyl][1,2,4]triazino[4,3-a]benzimidazol-4(1H)-one
Smiles: CCn1nc(C(=O)c2ccc(cc2)C)c(=O)n2c1nc1c2cccc1

STK069172
Synonyms: (2E)-2-[4-(3,5-diphenyl-4,5-dihydro-1H-pyrazol-1-yl)benzylidene]hydrazinecarboximidamide
Smiles: NC(=N)N/N=C/c1ccc(cc1)N1N=C(CC1c1ccccc1)c1ccccc1

STK069174
Synonyms: N'-(3,5-di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-4-methoxybenzohydrazide
Smiles: COc1ccc(cc1)C(=O)N/N=C/1\C=C(C(=O)C(=C1)C(C)(C)C)C(C)(C)C

STK069195
Synonyms: 4-benzyl-3-(4-fluorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)c1nnc(n1Cc1ccccc1)c1ccc(cc1)F

STK069227
Synonyms: 1-[(E)-({2-[(trimethylsilyl)oxy]ethyl}imino)methyl]naphthalen-2-ol
Smiles: Oc1ccc2c(c1/C=N/CCO[Si](C)(C)C)cccc2

STK069231
Synonyms: methyl3-[(2,3-dichlorophenyl)carbamoyl]-5-nitrobenzoate
Smiles: COC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)Nc1cccc(c1Cl)Cl

STK069270
Synonyms: 3-oxo-N-(pyridin-2-yl)-3H-benzo[f]chromene-2-carboxamide
Smiles: O=C(c1cc2c(oc1=O)ccc1c2cccc1)Nc1ccccn1

STK069273
Synonyms: 1-methyl-3-{4-[(7-methyloctyl)oxy]phenyl}pyrrolidine-2,5-dione
Smiles: CC(CCCCCCOc1ccc(cc1)C1CC(=O)N(C1=O)C)C

STK069281
Synonyms: 4-(5-{(Z)-[5-imino-2-(2-methylpropyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}furan-2-yl)benzoicacid
Smiles: CC(Cc1nn2c(=NC(=O)/C(=C\c3ccc(o3)c3ccc(cc3)C(=O)O)/C2=N)s1)C

STK069294
Synonyms: 3-[(2,6-dinitrophenyl)amino]phenol
Smiles: Oc1cccc(c1)Nc1c(cccc1[N+](=O)[O-])[N+](=O)[O-]

STK069295
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Smiles: CC(=O)Nc1ccc2c(c1)OCCO2

STK069310
Synonyms: (3E)-3-[2-(methoxyacetyl)hydrazinylidene]-N-(pyridin-2-yl)butanamide
Smiles: COCC(=O)N/N=C(/CC(=O)Nc1ccccn1)\C

STK069313
Synonyms: 1-(1,3-benzodioxol-5-ylmethyl)-4-hydroxy-6-methylpyridin-2(1H)-one
Smiles: Oc1cc(C)n(c(=O)c1)Cc1ccc2c(c1)OCO2

STK069314
Synonyms: N-ethyl-N-(4-methoxybenzyl)ethanamine
Smiles: CCN(Cc1ccc(cc1)OC)CC

STK069318
Synonyms: ethyl2-oxo-1,2,3,5,6,7,7a,12b-octahydro-4H-xantheno[9,8a-b]pyrrole-3-carboxylate
Smiles: CCOC(=O)C1C(=O)NC2C31CCCCC3Oc1c2cccc1

STK069324
Synonyms: 2-[(1E)-1-{2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]hydrazinylidene}ethyl]phenol
Smiles: Cc1ccc(cc1)c1csc(n1)N/N=C(/c1ccccc1O)\C

STK069332
Synonyms: 4-methoxy-3-nitro-N-(pyridin-2-ylcarbamothioyl)benzamide
Smiles: COc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1ccccn1

STK069336
Synonyms: 1-methyl-4-{[4-(4-nitrophenoxy)phenyl]sulfonyl}benzene
Smiles: Cc1ccc(cc1)S(=O)(=O)c1ccc(cc1)Oc1ccc(cc1)[N+](=O)[O-]

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