FULL DB

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

STK069343
Synonyms: 2-(5-amino-1,3,4-thiadiazol-2-yl)-N'-[(E)-{3-[2-(4-methylphenoxy)ethoxy]phenyl}methylidene]acetohydrazide
Smiles: O=C(Cc1nnc(s1)N)N/N=C/c1cccc(c1)OCCOc1ccc(cc1)C

STK069350
Synonyms: 2-[(E)-(1,3-benzothiazol-2-ylimino)methyl]-4-bromophenol
Smiles: Brc1ccc(c(c1)/C=N/c1nc2c(s1)cccc2)O

STK069427
Synonyms: N'-[(E)-{3-[3-(3,4-dimethylphenoxy)propoxy]phenyl}methylidene]acetohydrazide
Smiles: CC(=O)N/N=C/c1cccc(c1)OCCCOc1ccc(c(c1)C)C

STK069429
Synonyms: N,N,N',N',N'',N''-hexaethyl-2,4,6-trinitrobenzene-1,3,5-triamine
Smiles: CCN(c1c([N+](=O)[O-])c(N(CC)CC)c(c(c1[N+](=O)[O-])N(CC)CC)[N+](=O)[O-])CC

STK069432
Synonyms: 2,2'-{benzene-1,2-diylbis[nitrilo(E)methylylidene]}diphenol
Smiles: Oc1ccccc1/C=N/c1ccccc1/N=C/c1ccccc1O

STK069446
Synonyms: methyl4-({4-[3-(dimethylsulfamoyl)-4-methylphenyl]phthalazin-1-yl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)Nc1nnc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)N(C)C)C

STK069452
Synonyms: 2-amino-4-(4-butoxyphenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Smiles: CCCCOc1ccc(cc1)C1C(=C(N)OC2=C1C(=O)CC(C2)(C)C)C#N

STK069476
Synonyms: 3-phenyl-1,3-thiazolidine-2-carboxamide
Smiles: NC(=O)C1SCCN1c1ccccc1

STK069486
Synonyms: 3-bromo-N-(5-{[4-(dimethylamino)phenyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Smiles: Brc1cccc(c1)C(=O)Nc1nnc(s1)Sc1ccc(cc1)N(C)C

STK069490
Synonyms: 2-(3,4-dichlorophenyl)-3-(phenylamino)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1Cl)c1nc2ccccc2c(=O)n1Nc1ccccc1

STK069491
Synonyms: 4-(furan-2-ylcarbonyl)-N-[(4-nitrophenyl)carbonyl]piperazine-1-carboxamide
Smiles: O=C(N1CCN(CC1)C(=O)c1ccco1)NC(=O)c1ccc(cc1)[N+](=O)[O-]

STK069498
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-7-methylnaphthalene-2-sulfonamide
Smiles: Cc1ccc2c(c1)cc(cc2)S(=O)(=O)NCc1ccc2c(c1)OCO2

STK069501
Synonyms: N-(2-cyanophenyl)-4-hydroxy-1-(3-methylbutyl)-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: N#Cc1ccccc1NC(=O)c1c(O)c2ccccc2n(c1=O)CCC(C)C

STK069503
Synonyms: (2Z)-2,3-dimethyl-4-oxo-4-(tricyclo[3.3.1.1~3,7~]dec-1-ylamino)but-2-enoicacid
Smiles: O=C(/C(=C(\C(=O)O)/C)/C)NC12CC3CC(C2)CC(C1)C3

STK069523
Synonyms: 5-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-2-methylpyridine
Smiles: Cc1ccc(cn1)CCn1nc(cc1C)C

STK069526
Synonyms: 8-(heptylsulfanyl)-3-methyl-7-(4-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCSc1nc2c(n1Cc1ccc(cc1)C)c(=O)[nH]c(=O)n2C

STK069532
Synonyms: 2-[2-(diethylamino)ethoxy]ethyl2-phenylbutanoate2-hydroxypropane-1,2,3-tricarboxylate(salt)
Smiles: OC(=O)CC(C(=O)O)(CC(=O)O)O.CCC(c1ccccc1)C(=O)OCCOCCN(CC)CC

STK069551
Synonyms: (6Z)-2-cyclohexyl-6-{3,5-dichloro-4-[2-(2-methylphenoxy)ethoxy]benzylidene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: O=C1N=c2sc(nn2C(=N)/C/1=C/c1cc(Cl)c(c(c1)Cl)OCCOc1ccccc1C)C1CCCCC1

STK069604
Synonyms: 1-(2-fluorophenyl)-3-[5-(2-phenylethyl)-1,3,4-thiadiazol-2-yl]urea
Smiles: O=C(Nc1ccccc1F)Nc1nnc(s1)CCc1ccccc1

STK069617
Synonyms: (4Z)-4-[2-(4-fluorophenyl)hydrazinylidene]-5-methyl-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2,4-dihydro-3H-pyrazol-3-one
Smiles: Fc1ccc(cc1)N/N=C\1/C(=NN(C1=O)c1scc(n1)c1cccc(c1)[N+](=O)[O-])C

STK069638
Synonyms: 5-({[(3-butoxyphenyl)carbonyl]carbamothioyl}amino)-2-chlorobenzoicacid
Smiles: CCCCOc1cccc(c1)C(=O)NC(=S)Nc1ccc(c(c1)C(=O)O)Cl

STK069647
Synonyms: N'-(4-cyanophenyl)-N,N-diethylbutanediamide
Smiles: CCN(C(=O)CCC(=O)Nc1ccc(cc1)C#N)CC

STK069660
Synonyms: 6,6-dimethyl-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Smiles: O=c1[nH]c(=O)c2c([nH]1)sc1c2CC(OC1)(C)C

STK069667
Synonyms: 2-(naphthalen-2-yloxy)-1-[2,2,4-trimethyl-4-(4-methylphenyl)-3,4-dihydroquinolin-1(2H)-yl]ethanone
Smiles: Cc1ccc(cc1)C1(C)CC(C)(C)N(c2c1cccc2)C(=O)COc1ccc2c(c1)cccc2

STK069672
Synonyms: 6,6-dimethyl-2,3,4a,5,6,7,8,9,10,10a-decahydrobenzo[g]phthalazine-1,4-dione
Smiles: O=C1NNC(=O)C2C1CC1=C(C2)CCCC1(C)C

STK069674
Synonyms: (2Z)-1-[4-(4-fluorophenyl)piperazin-1-yl]-2,3-diphenylprop-2-en-1-one
Smiles: Fc1ccc(cc1)N1CCN(CC1)C(=O)/C(=C\c1ccccc1)/c1ccccc1

STK069693
Synonyms: (6Z)-6-{3-chloro-5-methoxy-4-[3-(4-methylphenoxy)propoxy]benzylidene}-5-imino-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1cc(cc(c1OCCCOc1ccc(cc1)C)Cl)/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1

STK069742
Synonyms: (2Z)-N-(4-chlorophenyl)-2-cyano-3-(1-cyclohexyl-2,5-dimethyl-1H-pyrrol-3-yl)prop-2-enamide
Smiles: N#C/C(=C/c1cc(n(c1C)C1CCCCC1)C)/C(=O)Nc1ccc(cc1)Cl

STK069748
Synonyms: N'-{(E)-[5-(3-chlorophenyl)furan-2-yl]methylidene}-2-methoxy-4-methylbenzohydrazide
Smiles: COc1cc(C)ccc1C(=O)N/N=C/c1ccc(o1)c1cccc(c1)Cl

STK069752
Synonyms: N-(5-chloro-2-methoxyphenyl)-1,3-benzodioxole-5-carboxamide
Smiles: COc1ccc(cc1NC(=O)c1ccc2c(c1)OCO2)Cl

STK069753
Synonyms: N,N-dimethyl-2-(3-nitrophenyl)ethanethioamide
Smiles: S=C(N(C)C)Cc1cccc(c1)[N+](=O)[O-]

STK069774
Synonyms: 4-chloro-N-(4-methoxyphenyl)-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
Smiles: COc1ccc(cc1)Nc1nc(Cl)nc(n1)OCC(F)(F)F

STK069777
Synonyms: (3-amino-6-hydroxy-4-methyl-7,7a-dihydrothieno[2,3-b]pyridin-2-yl)(phenyl)methanone
Smiles: O=C(C1=C(N)C2=C(C)C=C(NC2S1)O)c1ccccc1

STK069848
Synonyms: 2-(1,3-benzothiazol-2-ylcarbamoyl)benzoicacid
Smiles: O=C(c1ccccc1C(=O)O)Nc1nc2c(s1)cccc2

STK069862
Synonyms: N-{4-[(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)sulfamoyl]phenyl}acetamide
Smiles: COc1nc(nc(c1Cl)C)NS(=O)(=O)c1ccc(cc1)NC(=O)C

STK069872
Synonyms: potassium4-[(1E)-3,3-diethyltriaz-1-en-1-yl]benzoate
Smiles: CCN(/N=N/c1ccc(cc1)C(=O)[O-])CC.[K+]

STK069876
Synonyms: (2Z)-N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-6-methoxy-2-[(4-methylphenyl)imino]-2H-chromene-3-carboxamide
Smiles: COc1ccc2c(c1)cc(/c(=N/c1ccc(cc1)C)/o2)C(=O)Nc1scc(n1)c1ccc(c(c1)C)C

STK069878
Synonyms: 4-[(pyridin-2-ylmethyl)carbamoyl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)C(=O)NCc1ccccn1

STK069879
Synonyms: 2-{[5-(acetylamino)-1,3,4-thiadiazol-2-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc(s1)NC(=O)C

STK069887
Synonyms: 6-amino-3-tert-butyl-4-(4-chloro-1,3-benzodioxol-5-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc3c(c1Cl)OCO3)c([nH]n2)C(C)(C)C

STK069924
Synonyms: ethyl4-amino-2-[(4,7-dimethylquinazolin-2-yl)amino]-6-phenylpyrimidine-5-carboxylate
Smiles: CCOC(=O)c1c(N)nc(nc1c1ccccc1)Nc1nc(C)c2c(n1)cc(cc2)C

STK069972
Synonyms: N-(bicyclo[2.2.1]hept-2-yl)-4-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)benzamide
Smiles: O=C(c1ccc(cc1)CN1CCc2c(C1)cccc2)NC1CC2CC1CC2

STK069979
Synonyms: 1-[(N-acetylglycyl)(ethyl)amino]-N-(diphenylmethyl)cyclohexanecarboxamide
Smiles: CCN(C1(CCCCC1)C(=O)NC(c1ccccc1)c1ccccc1)C(=O)CNC(=O)C

STK070009
Synonyms: pyridin-2-yl3-chlorobenzoate
Smiles: Clc1cccc(c1)C(=O)Oc1ccccn1

STK070010
Synonyms: N-(4-fluorobenzyl)pyridine-2-carboxamide
Smiles: Fc1ccc(cc1)CNC(=O)c1ccccn1

STK070022
Synonyms: 5-cyano-8-methyl-4-oxo-2-thioxo-3-azaspiro[5.5]undecane-1-carboxamide
Smiles: N#CC1C(=O)NC(=S)C(C21CCCC(C2)C)C(=O)N

STK070031
Synonyms: methylN-(4-{[(5-methylfuran-2-yl)methyl]amino}-4-oxobutanoyl)leucinate
Smiles: COC(=O)C(NC(=O)CCC(=O)NCc1ccc(o1)C)CC(C)C

STK070056
Synonyms: 1-{(E)-amino[(4,6-dimethylquinazolin-2-yl)amino]methylidene}-3-cyclohexylurea
Smiles: Cc1ccc2c(c1)c(C)nc(n2)N/C(=N/C(=O)NC1CCCCC1)/N

STK070059
Synonyms: ethyl(2Z)-2-{4-[(4-chlorobenzyl)oxy]benzylidene}-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/c1ccc(cc1)OCc1ccc(cc1)Cl)/S2

STK070080
Synonyms: 3-hydroxy-2-(2-phenylethyl)-2,3,4,5,6,7-hexahydro-1H-isoindol-1-one
Smiles: O=C1C2=C(C(N1CCc1ccccc1)O)CCCC2

STK070096
Synonyms: {[acetyl(ethyl)amino]methyl}(morpholin-4-ylmethyl)phosphinicacid
Smiles: CCN(C(=O)C)CP(=O)(CN1CCOCC1)O

STK070115
Synonyms: 2-cyano-1-(2-methoxyphenyl)ethyl4-nitrobenzoate
Smiles: N#CCC(c1ccccc1OC)OC(=O)c1ccc(cc1)[N+](=O)[O-]

STK070120
Synonyms: N-benzyl-N-(2-phenylethyl)cyclohexanamine
Smiles: c1ccc(cc1)CCN(C1CCCCC1)Cc1ccccc1

STK070129
Synonyms: (4E)-4-[2-(2-hydroxy-4-methylphenyl)hydrazinylidene]-5-methyl-2-(4-phenyl-1,3-thiazol-2-yl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: Cc1ccc(c(c1)O)N/N=C/1\C(=NN(C1=O)c1scc(n1)c1ccccc1)C

STK070136
Synonyms: 3-(4-chlorobenzyl)-4-[(4-methoxyphenyl)amino]-4-oxobutanoicacid
Smiles: COc1ccc(cc1)NC(=O)C(Cc1ccc(cc1)Cl)CC(=O)O

STK070141
Synonyms: 1-[(N-acetylglycyl)(benzyl)amino]-N-(4-bromophenyl)cyclohexanecarboxamide
Smiles: CC(=O)NCC(=O)N(C1(CCCCC1)C(=O)Nc1ccc(cc1)Br)Cc1ccccc1

STK070143
Synonyms: 3-[(5Z)-5-(5-bromo-2-hydroxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoicacid
Smiles: OC(=O)CCN1C(=S)S/C(=C\c2cc(Br)ccc2O)/C1=O

STK070177
Synonyms: N-(2,5-dichlorophenyl)-1,3-benzodioxole-5-carboxamide
Smiles: Clc1ccc(c(c1)NC(=O)c1ccc2c(c1)OCO2)Cl

STK070178
Synonyms: 5-[(1,1-dioxido-1-benzothiophen-3-yl)sulfanyl]-1-phenyl-1H-tetrazole
Smiles: O=S1(=O)C=C(c2c1cccc2)Sc1nnnn1c1ccccc1

STK070203
Synonyms: 1-(2-iodophenyl)-1,4-dihydrobenzo[f]quinolin-3(2H)-one
Smiles: O=C1Nc2ccc3c(c2C(C1)c1ccccc1I)cccc3

STK070214
Synonyms: 1-{N-[2-chloro-5-(trifluoromethyl)phenyl]-N-(methylsulfonyl)glycyl}piperidine-4-carboxamide
Smiles: O=C(N1CCC(CC1)C(=O)N)CN(S(=O)(=O)C)c1cc(ccc1Cl)C(F)(F)F

STK070225
Synonyms: N-(5-{1-[(4-chlorophenyl)sulfonyl]-1H-benzimidazol-2-yl}pentyl)benzamide
Smiles: Clc1ccc(cc1)S(=O)(=O)n1c(CCCCCNC(=O)c2ccccc2)nc2c1cccc2

STK070242
Synonyms: N-benzyl-N-[2-(dimethylamino)ethyl]-3-(3-nitrophenyl)-3-oxo-2-(2-oxopyridin-1(2H)-yl)propanamide
Smiles: CN(CCN(C(=O)C(n1ccccc1=O)C(=O)c1cccc(c1)[N+](=O)[O-])Cc1ccccc1)C

STK070243
Synonyms: [(1R,9aR)-9a-methyloctahydro-2H-quinolizin-1-yl]methanol
Smiles: OC[C@@H]1CCCN2[C@]1(C)CCCC2

STK070250
Synonyms: ethyl{2-imino-3-[2-(4-methylphenoxy)ethyl]-2,3-dihydro-1H-benzimidazol-1-yl}acetate
Smiles: CCOC(=O)Cn1c(=N)n(c2c1cccc2)CCOc1ccc(cc1)C

STK070252
Synonyms: (10E)-7-(4-fluorophenyl)-10-(4-hydroxy-3,5-dinitrobenzylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Smiles: Fc1ccc(cc1)C1C2=C(N=c3n1c(=O)/c(=C\c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])O)/s3)c1c(CC2)cccc1

STK070258
Synonyms: 2-(4-fluorophenyl)-N-(pentan-2-yl)acetamide
Smiles: CCCC(NC(=O)Cc1ccc(cc1)F)C

STK070262
Synonyms: 3-{[2'-(acetylamino)-4'-methyl-4,5'-bi-1,3-thiazol-2-yl]amino}benzoicacid
Smiles: CC(=O)Nc1sc(c(n1)C)c1csc(n1)Nc1cccc(c1)C(=O)O

STK070268
Synonyms: N-(4-methylphenyl)-4-(pyridin-2-yl)-1,3-thiazol-2-amine
Smiles: Cc1ccc(cc1)Nc1scc(n1)c1ccccn1

STK070275
Synonyms: 6-amino-1-benzyl-4-(4-chlorophenyl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1)Cl)c(C)nn2Cc1ccccc1

STK070278
Synonyms: 4-({3-[(4-chlorophenyl)carbamoyl]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}amino)-4-oxobutanoicacid
Smiles: CC1CCc2c(C1)sc(c2C(=O)Nc1ccc(cc1)Cl)NC(=O)CCC(=O)O

STK070326
Synonyms: 4-{(2Z)-2-[5-oxo-3-phenyl-1-(4-phenyl-1,3-thiazol-2-yl)-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazinyl}benzenesulfonicacid
Smiles: O=C1N(N=C(/C/1=N/Nc1ccc(cc1)S(=O)(=O)O)c1ccccc1)c1scc(n1)c1ccccc1

STK070331
Synonyms: N,4-dimethyl-3-nitrobenzamide
Smiles: CNC(=O)c1ccc(c(c1)[N+](=O)[O-])C

STK070350
Synonyms: 2-({3-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-methoxyphenyl}sulfonyl)ethylsulfate
Smiles: COc1ccc(cc1Nc1nc(Cl)nc(n1)Cl)S(=O)(=O)CCOS(=O)(=O)[O-]

STK070354
Synonyms: 1-(2-hydroxybenzyl)-N-(6-hydroxy-6-methylheptan-2-yl)piperidine-4-carboxamide
Smiles: CC(NC(=O)C1CCN(CC1)Cc1ccccc1O)CCCC(O)(C)C

STK070388
Synonyms: N-[(E)-1H-indol-3-ylmethylidene]-3-nitroaniline
Smiles: [O-][N+](=O)c1cccc(c1)/N=C/c1c[nH]c2c1cccc2

STK070406
Synonyms: 3-[(phenylcarbonyl)amino]-1-benzofuran-2-carboxamide
Smiles: O=C(c1ccccc1)Nc1c(oc2c1cccc2)C(=O)N

STK070438
Synonyms: N-(1-phenylpropan-2-yl)-1-benzofuran-2-carboxamide
Smiles: CC(NC(=O)c1cc2c(o1)cccc2)Cc1ccccc1

STK070451
Synonyms: 2-[4-(2-hydroxyethyl)piperazin-1-yl]-1-(5-methoxy-2-methyl-1-benzofuran-3-yl)ethanone
Smiles: OCCN1CCN(CC1)CC(=O)c1c(C)oc2c1cc(OC)cc2

STK070455
Synonyms: 1-[3-oxo-2-(2-oxopyridin-1(2H)-yl)-3-phenylpropanoyl]-N-(2-phenylethyl)piperidine-4-carboxamide
Smiles: O=C(C1CCN(CC1)C(=O)C(n1ccccc1=O)C(=O)c1ccccc1)NCCc1ccccc1

STK070488
Synonyms: 2-chloro-5-({[(2-chloro-5-iodophenyl)carbonyl]carbamothioyl}amino)benzoicacid
Smiles: S=C(NC(=O)c1cc(I)ccc1Cl)Nc1ccc(c(c1)C(=O)O)Cl

STK070492
Synonyms: 2-[(4-chlorophenyl)sulfanyl]-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)acetamide
Smiles: N#Cc1c(NC(=O)CSc2ccc(cc2)Cl)sc2c1CCC2

STK070525
Synonyms: 4-methylbenzyl(pyridin-3-ylmethyl)carbamate
Smiles: O=C(NCc1cccnc1)OCc1ccc(cc1)C

STK070533
Synonyms: methylN-(4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-oxobutanoyl)leucinate
Smiles: COC(=O)C(NC(=O)CCC(=O)NCCc1ccc(c(c1)OC)OC)CC(C)C

STK070547
Synonyms: 2-[(E)-2-(4-bromophenyl)ethenyl]-3-methylquinazolin-4(3H)-one
Smiles: Brc1ccc(cc1)/C=C/c1nc2ccccc2c(=O)n1C

STK070555
Synonyms: 1-(3,4-dimethylphenyl)-3-[5-(1-phenylpropyl)-1,3,4-thiadiazol-2-yl]urea
Smiles: CCC(c1ccccc1)c1nnc(s1)NC(=O)Nc1ccc(c(c1)C)C

STK070585
Synonyms: (6Z)-6-{3-chloro-4-[2-(2,4-dimethylphenoxy)ethoxy]-5-ethoxybenzylidene}-5-imino-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Smiles: CCOc1cc(cc(c1OCCOc1ccc(cc1C)C)Cl)/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1

STK070592
Synonyms:
Smiles: O=C(COc1c(C)cc(cc1C)Br)N/N=C\c1cc(O)ccc1[N+](=O)[O-].O=C(COc1c(C)cc(cc1C)Br)N/N=C\c1cc(O)ccc1[N+](=O)[O-]

STK070595
Synonyms: N-(4-methoxyphenyl)-9-methyl-9H-fluorene-9-carboxamide
Smiles: COc1ccc(cc1)NC(=O)C1(C)c2ccccc2c2c1cccc2

STK070604
Synonyms: 4-[(E)-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]imino}methyl]benzene-1,3-diol
Smiles: Oc1ccc(c(c1)O)/C=N/c1ccc(cc1)c1nc2c(s1)cc(cc2)C

STK070643
Synonyms: 2-[(2Z)-2-{1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene}hydrazinyl]anthracene-9,10-dione
Smiles: COc1ccc(cc1)c1csc(n1)N1N=C(/C(=N/Nc2ccc3c(c2)C(=O)c2c(C3=O)cccc2)/C1=O)C

STK070645
Synonyms: diethyl5-{[(furan-2-ylcarbonyl)carbamothioyl]amino}-3-methylthiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)c2ccco2)sc(c1C)C(=O)OCC

STK070653
Synonyms: 4-benzyl-1-[4-(4-methoxyphenyl)butan-2-yl]piperidine
Smiles: COc1ccc(cc1)CCC(N1CCC(CC1)Cc1ccccc1)C

STK070655
Synonyms: 4-(5-{(Z)-[7-(2-methoxyphenyl)-9-oxo-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-10(9H)-ylidene]methyl}furan-2-yl)-3-methylbenzoicacid
Smiles: COc1ccccc1C1C2=C(N=c3n1c(=O)/c(=C/c1ccc(o1)c1ccc(cc1C)C(=O)O)/s3)c1c(CC2)cccc1

STK070661
Synonyms: 4,4'-[(1,3,5,7-tetraoxo-5,7-dihydropyrrolo[3,4-f]isoindole-2,6(1H,3H)-diyl)bis(benzene-3,1-diyloxy)]dibenzene-1,2-dicarboxylicacid
Smiles: OC(=O)c1cc(ccc1C(=O)O)Oc1cccc(c1)n1c(=O)c2c(c1=O)cc1c(c2)c(=O)n(c1=O)c1cccc(c1)Oc1ccc(c(c1)C(=O)O)C(=O)O

STK070669
Synonyms: 3-({(E)-[4-(benzyloxy)phenyl]methylidene}amino)phenol
Smiles: Oc1cccc(c1)/N=C/c1ccc(cc1)OCc1ccccc1

STK070676
Synonyms: 1,6-dimethyl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridin-4-amine
Smiles: Cc1cc(N)c2c(n1)N(C)CC2

STK070680
Synonyms: (6E)-3-hydroxy-1,7-dimethyl-4-(propan-2-yl)-11-oxabicyclo[8.1.0]undec-6-en-5-ylbenzoate
Smiles: CC1=CC(OC(=O)c2ccccc2)C(C(C)C)C(CC2(C(CC1)O2)C)O

STK070689
Synonyms: 2-[5-(2-bromo-5-methoxyphenyl)-1,2,4-oxadiazol-3-yl]pyridine
Smiles: COc1ccc(c(c1)c1onc(n1)c1ccccn1)Br

STK070700
Synonyms: 4,6-dimethyl-2-[(2-phenylethyl)sulfanyl]pyridine-3-carbonitrile
Smiles: N#Cc1c(C)cc(nc1SCCc1ccccc1)C

STK070736
Synonyms: (2Z,5Z)-5-(5-chloro-2-methoxybenzylidene)-3-(2-phenylethyl)-2-(phenylimino)-1,3-thiazolidin-4-one
Smiles: COc1ccc(cc1/C=C/1\S/C(=N\c2ccccc2)/N(C1=O)CCc1ccccc1)Cl

STK070744
Synonyms: N'-[(2E)-3-hydroxybutan-2-ylidene]pyridine-4-carbohydrazide
Smiles: CC(/C(=N/NC(=O)c1ccncc1)/C)O

STK070817
Synonyms: 2,4-dichloro-6-[(E)-{[4-chloro-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]imino}methyl]phenol
Smiles: Clc1cc(/C=N/c2ccc(c(c2)c2oc3c(n2)nccc3)Cl)c(c(c1)Cl)O

STK070829
Synonyms: 3-(4-bromophenyl)-5-(2,5-dichlorophenyl)-3a,6a-dihydrospiro[furo[3,4-c]pyrrole-1,2'-indene]-1',3',4,6(3H,5H)-tetrone
Smiles: Brc1ccc(cc1)C1OC2(C3C1C(=O)N(C3=O)c1cc(Cl)ccc1Cl)C(=O)c1c(C2=O)cccc1

STK070832
Synonyms: 3-({[(4-tert-butylphenoxy)acetyl]carbamothioyl}amino)-2-methylbenzoicacid
Smiles: O=C(NC(=S)Nc1cccc(c1C)C(=O)O)COc1ccc(cc1)C(C)(C)C

STK070837
Synonyms: N,N'-[sulfanediylbis(2-phenyl-1H-inden-3-yl-1-ylidene)]bis(4-chloroaniline)
Smiles: Clc1ccc(cc1)/N=C/1\c2ccccc2C(=C1c1ccccc1)SC1=C(c2ccccc2)/C(=N\c2ccc(cc2)Cl)/c2c1cccc2

STK070841
Synonyms: 2-imino-6-nitro-N-(4-phenyl-1,3-thiazol-2-yl)-2H-chromene-3-carboxamide
Smiles: O=C(c1cc2cc(ccc2oc1=N)[N+](=O)[O-])Nc1scc(n1)c1ccccc1

STK070849
Synonyms: N'-[(3Z)-1-benzyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene]pyridine-4-carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/1\C(=O)N(c2c1cccc2)Cc1ccccc1

STK070878
Synonyms: N-[(2Z)-3-chlorobut-2-en-1-yl]cyclohexanaminehydrochloride
Smiles: C/C(=C/CNC1CCCCC1)/Cl.Cl

STK070891
Synonyms: 5-({1-[2-(4-chloro-3-methylphenoxy)ethyl]-2-methyl-1H-indol-3-yl}methylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1N(C)C(=O)C(=Cc2c(C)n(c3c2cccc3)CCOc2ccc(c(c2)C)Cl)C(=O)N1C

STK070914
Synonyms: 1-{4-[(E)-(4-propoxyphenyl)diazenyl]phenyl}ethanone
Smiles: CCCOc1ccc(cc1)/N=N/c1ccc(cc1)C(=O)C

STK070926
Synonyms: (2E,2'E)-2,2'-(1E,2E)-ethane-1,2-diylidenedihydrazinecarboxamide
Smiles: NC(=O)N/N=C/C=N/NC(=O)N

STK070948
Synonyms: ethyl2-{(5E)-5-[2-(benzyloxy)benzylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}propanoate
Smiles: CCOC(=O)C(N1C(=O)S/C(=C/c2ccccc2OCc2ccccc2)/C1=O)C

STK070978
Synonyms: 2-(2-chlorophenyl)-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4-ol
Smiles: Clc1ccccc1C1N=C(O)c2c(N1)sc1c2CCCC1

STK071020
Synonyms: 11-(2-hydrazinylethyl)-6,11-dihydro-5H-benzo[a]carbazole
Smiles: NNCCn1c2ccccc2c2c1c1ccccc1CC2

STK071027
Synonyms: N-[3-cyano-4-(4-fluorophenyl)-4H-benzo[h]chromen-2-yl]benzamide
Smiles: N#CC1=C(NC(=O)c2ccccc2)Oc2c(C1c1ccc(cc1)F)ccc1c2cccc1

STK071039
Synonyms: 1-(phenylsulfonyl)-3-propyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol
Smiles: CCCC1=NN(C(C1)(O)C(F)(F)F)S(=O)(=O)c1ccccc1

STK071050
Synonyms: 2-bromo-4-(2-chlorophenyl)-6-(thiophen-2-yl)pyridine-3-carbonitrile
Smiles: N#Cc1c(Br)nc(cc1c1ccccc1Cl)c1cccs1

STK071053
Synonyms: 1,3-dimethyl-5-nitro-6-[(E)-2-(pyridin-3-yl)ethenyl]pyrimidine-2,4(1H,3H)-dione
Smiles: O=c1n(C)c(/C=C/c2cccnc2)c(c(=O)n1C)[N+](=O)[O-]

STK071060
Synonyms: dipotassium4-[(2-carboxylatophenyl)amino]-3,3-dimethyl-2-(propan-2-yl)-1,2,3,4-tetrahydroquinoline-8-carboxylate
Smiles: [K]OC(=O)c1ccccc1NC1c2cccc(c2NC(C1(C)C)C(C)C)C(=O)O[K]

STK071063
Synonyms: N-ethyl-N-(2-methoxybenzyl)ethanamine
Smiles: CCN(Cc1ccccc1OC)CC

STK071081
Synonyms: 3-(2-hydroxyethyl)-4,6-dimethyl-2-oxo-2,3-dihydropyrimidin-1-ium
Smiles: Cc1cc(C)[nH+]c(=O)n1CCO

STK071093
Synonyms: 5-(3,4-dimethoxyphenyl)-3-(4-methylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: COc1cc(ccc1OC)c1csc2c1c(=O)n(cn2)c1ccc(cc1)C

STK071104
Synonyms: N-{4-[(2,4-dimethylphenyl)sulfamoyl]phenyl}-2-(naphthalen-1-yloxy)acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1C)C)COc1cccc2c1cccc2

STK071122
Synonyms: (6Z)-6-(3-ethoxy-4-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}benzylidene)-5-imino-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Smiles: CCOc1cc(ccc1OCCOc1ccccc1CC=C)/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1

STK071140
Synonyms: 1-{4-[(3-methylpiperidin-1-yl)carbonyl]piperidin-1-yl}-3-(3-nitrophenyl)-2-(2-oxopyridin-1(2H)-yl)propane-1,3-dione
Smiles: CC1CCCN(C1)C(=O)C1CCN(CC1)C(=O)C(n1ccccc1=O)C(=O)c1cccc(c1)[N+](=O)[O-]

STK071147
Synonyms: ethyl2-{[({[(E)-(2-hydroxyphenyl)methylidene]amino}oxy)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CO/N=C/c2ccccc2O)sc2c1CCCC2

STK071158
Synonyms: diethyl2,5-bis(3-ethoxy-3-oxoprop-1-yn-1-yl)benzene-1,4-dicarboxylate
Smiles: CCOC(=O)c1cc(C#CC(=O)OCC)c(cc1C#CC(=O)OCC)C(=O)OCC

STK071167
Synonyms: 5-(pyridin-3-ylmethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)C(=Cc2cccnc2)C(=O)N1

STK071190
Synonyms: 2,2-dichloro-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide
Smiles: O=C(C(Cl)Cl)Nc1nc2c(s1)cc(cc2)[N+](=O)[O-]

STK071191
Synonyms: 3-(morpholin-4-ylamino)-2-benzofuran-1(3H)-one
Smiles: O=C1OC(c2c1cccc2)NN1CCOCC1

STK071201
Synonyms: 2,2'-(oxydibenzene-4,1-diyl)bis[5-(2-methylphenyl)-1,3,4-oxadiazole]
Smiles: Cc1ccccc1c1nnc(o1)c1ccc(cc1)Oc1ccc(cc1)c1nnc(o1)c1ccccc1C

STK071204
Synonyms: 2-methoxy-2-methyl-1-{[2-propanoyl-5-(propan-2-yl)phenyl]amino}-6-(propan-2-yl)-1,2-dihydro-3H-indol-3-one
Smiles: CCC(=O)c1ccc(cc1NN1c2cc(ccc2C(=O)C1(C)OC)C(C)C)C(C)C

STK071207
Synonyms: pyridin-2-ylfuran-2-carboxylate
Smiles: O=C(c1ccco1)Oc1ccccn1

STK071214
Synonyms: N'-[(E)-(2-bromo-5-hydroxyphenyl)methylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide
Smiles: Oc1ccc(c(c1)/C=N/NC(=O)C1COc2c(O1)cccc2)Br

STK071246
Synonyms: N-[2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]-N-(furan-2-ylmethyl)propanamide
Smiles: CCCOc1ccc(cc1)N1C(=O)CC(C1=O)N(C(=O)CC)Cc1ccco1

STK071250
Synonyms: 2-chloro-4-({[(3,4-dimethylphenyl)carbonyl]carbamothioyl}amino)benzoicacid
Smiles: S=C(NC(=O)c1ccc(c(c1)C)C)Nc1ccc(c(c1)Cl)C(=O)O

STK071254
Synonyms: 2-[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]-1-phenylethanone
Smiles: CCNc1nc(nc(n1)NCC)CC(=O)c1ccccc1

STK071260
Synonyms: 3-[(4-tert-butylcyclohexylidene)amino]-2-thioxo-1,3-thiazolidin-4-one
Smiles: O=C1CSC(=S)N1/N=C/1\CCC(CC1)C(C)(C)C

STK071268
Synonyms: N'-{(E)-phenyl[4-(trifluoromethyl)phenyl]methylidene}pyridine-3-carbohydrazide
Smiles: O=C(c1cccnc1)N/N=C(/c1ccc(cc1)C(F)(F)F)\c1ccccc1

STK071272
Synonyms: 2-(4-methoxyphenyl)-4-phenyl-1,4-dihydropyrimido[1,2-a]benzimidazole
Smiles: COc1ccc(cc1)C1=CC(n2c(N1)nc1c2cccc1)c1ccccc1

STK071277
Synonyms: 2-amino-4-{3-[(4-chlorobenzyl)oxy]-4-methoxyphenyl}-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(c(c1)OCc1ccc(cc1)Cl)OC)c(=O)oc(c2)C

STK071281
Synonyms: 3-[(3-hydroxypropyl)amino]-1-(4-methoxyphenyl)pyrrolidine-2,5-dione
Smiles: OCCCNC1CC(=O)N(C1=O)c1ccc(cc1)OC

STK071284
Synonyms: 2-(4-fluorophenyl)-1-(4-methylpiperazin-1-yl)ethanone
Smiles: CN1CCN(CC1)C(=O)Cc1ccc(cc1)F

STK071291
Synonyms: 3-(3,4-dichlorophenyl)-1-(2,5-dioxo-1-phenylpyrrolidin-3-yl)-1-(4-methoxybenzyl)urea
Smiles: COc1ccc(cc1)CN(C1CC(=O)N(C1=O)c1ccccc1)C(=O)Nc1ccc(c(c1)Cl)Cl

STK071296
Synonyms: 2-(4-chlorobenzyl)-4,8-diethoxy-1,3-dimethyl-2,6-dihydrocyclohepta[c]pyrrol-6-ylium
Smiles: CCOC1=C[CH+]C=C(c2c1c(C)n(c2C)Cc1ccc(cc1)Cl)OCC

STK071310
Synonyms: N-{[4-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}furan-2-carboxamide
Smiles: S=C(NC(=O)c1ccco1)Nc1ccc(cc1)c1oc2c(n1)cc(c(c2)C)C

STK071319
Synonyms: 3-(4-chlorophenyl)-N'-[(E)-(4-ethylphenyl)methylidene]-1H-pyrazole-5-carbohydrazide
Smiles: CCc1ccc(cc1)/C=N/NC(=O)c1[nH]nc(c1)c1ccc(cc1)Cl

STK071320
Synonyms: bis(4-ethoxyphenyl)iodonium
Smiles: CCOc1ccc(cc1)[I+]c1ccc(cc1)OCC

STK071394
Synonyms: N-(2,5-dimethoxy-4-{[(2E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]amino}phenyl)benzamide
Smiles: COc1cc(NC(=O)c2ccccc2)c(cc1NC(=O)/C=C/c1cc(OC)c(c(c1)OC)OC)OC

STK071407
Synonyms: 8,8-dimethyl-5-phenyl-3,6,8,9-tetrahydropyrano[4,3-d]pyrazolo[3,4-b]pyridin-1-ol
Smiles: Oc1n[nH]c2c1c1CC(C)(C)OCc1c(n2)c1ccccc1

STK071416
Synonyms: 7-tert-butyl-2-[4-(dimethylamino)phenyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CN(c1ccc(cc1)c1nc2sc3c(c2c(=O)[nH]1)CCC(C3)C(C)(C)C)C

STK071433
Synonyms: (4E)-4-({1-[2-(4-chloro-3-methylphenoxy)ethyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC1=NN(C(=O)/C/1=C/c1cn(c2c1cccc2)CCOc1ccc(c(c1)C)Cl)c1ccccc1

STK071452
Synonyms: 5-({1-[2-(4-chloro-2-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(cc2C)Cl)C(=O)N1

STK071454
Synonyms: N-[4-(benzyloxy)phenyl]-4-methoxybenzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)OCc1ccccc1

STK071459
Synonyms: 2,3-dihydro-1H-indol-1-yl(4,5-dimethoxy-2-nitrophenyl)methanone
Smiles: COc1cc(c(cc1OC)[N+](=O)[O-])C(=O)N1CCc2c1cccc2

STK071477
Synonyms: N,N-diphenyl-4-(1,1,2,2-tetrafluoroethoxy)-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazin-2-amine
Smiles: FC(C(Oc1nc(OCC(C(F)F)(F)F)nc(n1)N(c1ccccc1)c1ccccc1)(F)F)F

STK071481
Synonyms: N-tert-butyl-N'-(4-nitrophenyl)butanediamide
Smiles: O=C(Nc1ccc(cc1)[N+](=O)[O-])CCC(=O)NC(C)(C)C

STK071492
Synonyms: 4-phenyl-N'-[(4-propylphenyl)acetyl]cyclohexanecarbohydrazide
Smiles: CCCc1ccc(cc1)CC(=O)NNC(=O)C1CCC(CC1)c1ccccc1

STK071502
Synonyms: methyl6-(3-methoxy-4-{2-oxo-2-[(2E)-2-(pyridin-2-ylmethylidene)hydrazinyl]ethoxy}phenyl)-4-methyl-2-oxo-1,2-dihydropyrimidine-5-carboxylate
Smiles: COC(=O)c1c(C)nc(=O)[nH]c1c1ccc(c(c1)OC)OCC(=O)N/N=C/c1ccccn1

STK071592
Synonyms: 3-ethyl-1-[(4-methylphenyl)sulfonyl]-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol
Smiles: CCC1=NN(C(C1)(O)C(F)(F)F)S(=O)(=O)c1ccc(cc1)C

STK071614
Synonyms: (5E)-1-(4-chlorophenyl)-5-(4-{2-[(4-chlorophenyl)sulfanyl]ethoxy}benzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Clc1ccc(cc1)SCCOc1ccc(cc1)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)Cl

STK071647
Synonyms: N'-[(1E)-1-(biphenyl-4-yl)ethylidene]-2-{[1-(4-methylbenzyl)-1H-benzimidazol-2-yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nc2c(n1Cc1ccc(cc1)C)cccc2)N/N=C(/c1ccc(cc1)c1ccccc1)\C

STK071662
Synonyms: N-[2-(diethylamino)ethyl]-3-(4-fluorophenyl)-3-oxo-2-(2-oxopyridin-1(2H)-yl)propanamide
Smiles: CCN(CCNC(=O)C(n1ccccc1=O)C(=O)c1ccc(cc1)F)CC

STK071697
Synonyms: 2-(3,4-dimethoxyphenyl)-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4-ol
Smiles: COc1cc(ccc1OC)C1N=C(O)c2c(N1)sc1c2CCCC1

STK071702
Synonyms: (2E)-N-benzyl-3-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}phenyl)-2-cyanoprop-2-enamide
Smiles: CCC(c1ccc(cc1)OCCOc1ccc(cc1)/C=C(/C(=O)NCc1ccccc1)\C#N)C

STK071733
Synonyms: (6Z)-6-{3-bromo-4-[(3,4-dichlorobenzyl)oxy]-5-ethoxybenzylidene}-5-imino-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Smiles: CCOc1cc(cc(c1OCc1ccc(c(c1)Cl)Cl)Br)/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1

STK071742
Synonyms: S-{4-[cyano(methyl)amino]-6-(dimethylamino)-1,3,5-triazin-2-yl}phenylcarbamothioate
Smiles: N#CN(c1nc(SC(=O)Nc2ccccc2)nc(n1)N(C)C)C

STK071745
Synonyms: N-{4-[(4,6-dimethoxypyrimidin-2-yl)sulfamoyl]phenyl}-N'-(thiophen-2-ylmethyl)butanediamide
Smiles: COc1cc(OC)nc(n1)NS(=O)(=O)c1ccc(cc1)NC(=O)CCC(=O)NCc1cccs1

STK071767
Synonyms: N~3~-ethyl-N-(2-methoxy-5-nitrophenyl)-N~3~-(2-methylprop-2-en-1-yl)-beta-alaninamide
Smiles: CCN(CC(=C)C)CCC(=O)Nc1cc(ccc1OC)[N+](=O)[O-]

STK071770
Synonyms: (4Z)-4-(5-chloro-2-hydroxy-3-nitrobenzylidene)-1-(3-chlorophenyl)pyrazolidine-3,5-dione
Smiles: Clc1cc(/C=C\2/C(=O)NN(C2=O)c2cccc(c2)Cl)c(c(c1)[N+](=O)[O-])O

STK071779
Synonyms: N-(4-bromophenyl)-2-imino-8-methoxy-2H-chromene-3-carboxamide
Smiles: COc1cccc2c1oc(=N)c(c2)C(=O)Nc1ccc(cc1)Br

STK071794
Synonyms: quinolin-8-yl2,3-dihydro-1,4-benzodioxine-2-carboxylate
Smiles: O=C(C1COc2c(O1)cccc2)Oc1cccc2c1nccc2

STK071829
Synonyms: 5-benzyl-5-{[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]methyl}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)C(C(=O)N1)(CN1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Cc1ccccc1

STK071832
Synonyms: 1-(morpholin-4-yl)-2-[2-({[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]amino}methyl)phenoxy]ethanone
Smiles: O=C(N1CCOCC1)COc1ccccc1CNC(C12CC3CC(C2)CC(C1)C3)C

STK071840
Synonyms: N-(4,6-dimethylpyrimidin-2-yl)-5-(2-nitrophenyl)furan-2-carboxamide
Smiles: Cc1cc(C)nc(n1)NC(=O)c1ccc(o1)c1ccccc1[N+](=O)[O-]

STK071900
Synonyms: (5Z)-5-(4-methylbenzylidene)-3-phenyl-1,3-thiazolidine-2,4-dione
Smiles: Cc1ccc(cc1)/C=C/1\SC(=O)N(C1=O)c1ccccc1

STK071914
Synonyms: (4Z)-4-(5-chloro-2-hydroxy-3-methoxybenzylidene)-1-(3-chlorophenyl)pyrazolidine-3,5-dione
Smiles: COc1cc(Cl)cc(c1O)/C=C\1/C(=O)NN(C1=O)c1cccc(c1)Cl

STK071923
Synonyms: 3-(3,5-di-tert-butyl-4-hydroxyphenyl)-N-(2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)propanamide
Smiles: O=C(Nc1c2CCCc2nc2c1cccc2)CCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C

STK071936
Synonyms: 3-(2-methylprop-2-en-1-yl)-2-[(4-nitrobenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CC(=C)Cn1c(SCc2ccc(cc2)[N+](=O)[O-])nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK071976
Synonyms: bis(2-chlorophenyl)bromonium
Smiles: Clc1ccccc1[Br+]c1ccccc1Cl

STK071985
Synonyms: (2Z)-3-(5-bromo-2-hydroxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
Smiles: N#C/C(=C\c1cc(Br)ccc1O)/c1ccc(cc1)[N+](=O)[O-]

STK071994
Synonyms: N-[(E)-(1-{2-[2-(butan-2-yl)phenoxy]ethyl}-1H-indol-3-yl)methylidene]-4H-1,2,4-triazol-4-amine
Smiles: CCC(c1ccccc1OCCn1cc(c2c1cccc2)/C=N/n1cnnc1)C

STK072041
Synonyms: 2,3-bis(benzylsulfanyl)-1-(4-bromophenyl)-3-phenylpropan-1-one
Smiles: Brc1ccc(cc1)C(=O)C(C(c1ccccc1)SCc1ccccc1)SCc1ccccc1

STK072086
Synonyms: 4-methoxy-N-[(4-methoxyphenyl)carbamothioyl]-3-nitrobenzamide
Smiles: COc1ccc(cc1)NC(=S)NC(=O)c1ccc(c(c1)[N+](=O)[O-])OC

STK072090
Synonyms: 3-chloro-6-[(2E)-2-(2-chloro-6-fluorobenzylidene)hydrazinyl]pyridazine
Smiles: Clc1ccc(nn1)N/N=C/c1c(F)cccc1Cl

STK072093
Synonyms: N'-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-2,3-dihydro-1,4-benzodioxine-6-carbohydrazide
Smiles: O=C(c1ccc2c(c1)OCCO2)NNC(=O)c1ccc2c(c1)OCCO2

STK072158
Synonyms: N'-[(E)-(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]-2-(naphthalen-1-ylamino)acetohydrazide(non-preferredname)
Smiles: O=C(CNc1cccc2c1cccc2)N/N=C/c1cc(Br)cc(c1O)[N+](=O)[O-]

STK072174
Synonyms: 2-(3,4-dichlorophenyl)-2-oxoethyl(2-oxo-3,4-dihydro-2H-1,4-benzoxazin-3-yl)acetate
Smiles: O=C(CC1Nc2ccccc2OC1=O)OCC(=O)c1ccc(c(c1)Cl)Cl

STK072177
Synonyms: 6-ethyl-7-methyl-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Smiles: CCc1c(C)nc2n(c1=O)nc(s2)c1ccccc1

STK072187
Synonyms: 4-amino-2-(3,4-dimethoxyphenyl)-5H-chromeno[4,3-d]pyrimidin-5-one
Smiles: COc1cc(ccc1OC)c1nc(N)c2c(n1)c1ccccc1oc2=O

STK072193
Synonyms: diethyl2-{[(2-fluorophenyl)carbonyl]amino}-4,7-dihydrothieno[2,3-c]pyridine-3,6(5H)-dicarboxylate
Smiles: CCOC(=O)c1c(sc2c1CCN(C2)C(=O)OCC)NC(=O)c1ccccc1F

STK072239
Synonyms: N-cyclohexyl-3-(3-nitrophenyl)-3-oxo-2-(2-oxopyridin-1(2H)-yl)propanamide
Smiles: O=c1ccccn1C(C(=O)c1cccc(c1)[N+](=O)[O-])C(=O)NC1CCCCC1

STK072262
Synonyms: 6-tert-butyl-2-{[(E)-(3-ethoxy-4-hydroxyphenyl)methylidene]amino}-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: CCOc1cc(/C=N/c2sc3c(c2C(=O)Nc2ccccc2)CCC(C3)C(C)(C)C)ccc1O

STK072283
Synonyms: 5-[3-methoxy-4-(naphthalen-1-ylmethoxy)-5-(prop-2-en-1-yl)benzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: C=CCc1cc(C=C2C(=O)NC(=S)NC2=O)cc(c1OCc1cccc2c1cccc2)OC

STK072324
Synonyms: N-[2-(2-fluorophenyl)-1,3-benzoxazol-5-yl]-3,5-dinitrobenzamide
Smiles: O=C(c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])Nc1ccc2c(c1)nc(o2)c1ccccc1F

STK072326
Synonyms: pyridin-3-yl1,3-benzodioxole-5-carboxylate
Smiles: O=C(c1ccc2c(c1)OCO2)Oc1cccnc1

STK072348
Synonyms: (2Z)-3-(4-fluorobenzyl)-5-propyl-2-[(2E)-(thiophen-2-ylmethylidene)hydrazinylidene]-1,3-thiazolidin-4-one
Smiles: CCCC1S/C(=N\N=C\c2cccs2)/N(C1=O)Cc1ccc(cc1)F

STK072359
Synonyms: 3-(3,3-dichloroprop-2-en-1-yl)-2-methoxy-2-methyl-2,3-dihydro-1,5-benzoxazepin-4(5H)-one
Smiles: COC1(C)Oc2ccccc2NC(=O)C1CC=C(Cl)Cl

STK072360
Synonyms: 2-{[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(4-methoxyphenyl)ethanonehydrobromide
Smiles: COc1ccc(cc1)C(=O)CSc1nnc(o1)c1ccc(cc1)Br.Br

STK072361
Synonyms: 4-({(E)-[3-(benzyloxy)phenyl]methylidene}amino)benzenesulfonamide
Smiles: NS(=O)(=O)c1ccc(cc1)/N=C/c1cccc(c1)OCc1ccccc1

STK072392
Synonyms: 9-amino-3,3-dimethyl-3,4-dihydroacridin-1(2H)-one
Smiles: O=C1CC(C)(C)Cc2c1c(N)c1c(n2)cccc1

STK072396
Synonyms: N-(4-ethoxyphenyl)-2-(pyridin-3-yl)piperidine-1-carbothioamide
Smiles: CCOc1ccc(cc1)NC(=S)N1CCCCC1c1cccnc1

STK072397
Synonyms: 5-bromo-N-[(3-hydroxypyridin-2-yl)carbamothioyl]-2-methoxybenzamide
Smiles: COc1ccc(cc1C(=O)NC(=S)Nc1ncccc1O)Br

STK072401
Synonyms: 6-amino-7,7-dimethyl-6,7-dihydropyrazolo[1,5-c]pyrimidine-2,4-diol
Smiles: NN1C=C(O)c2n(C1(C)C)nc(c2)O

STK072407
Synonyms: 3-[(aminomethyl)sulfanyl]-1-(4-fluorophenyl)pyrrolidine-2,5-dione
Smiles: NCSC1CC(=O)N(C1=O)c1ccc(cc1)F

STK072423
Synonyms: (5E)-5-{3-bromo-5-methoxy-4-[(3-methylbenzyl)oxy]benzylidene}imidazolidine-2,4-dione
Smiles: COc1cc(/C=C\2/NC(=O)NC2=O)cc(c1OCc1cccc(c1)C)Br

STK072438
Synonyms: N-(16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)-2-(naphthalen-1-yl)acetamide(non-preferredname)
Smiles: O=C(Cc1cccc2c1cccc2)NN1C(=O)C2C(C1=O)C1c3c(C2c2c1cccc2)cccc3

STK072443
Synonyms: 1-(2-hydroxy-3-methoxybenzyl)-N-(3-methoxypropyl)piperidine-4-carboxamide
Smiles: COCCCNC(=O)C1CCN(CC1)Cc1cccc(c1O)OC

STK072449
Synonyms: N'-[(E)-(2-methyl-1-{2-[2-(prop-2-en-1-yl)phenoxy]ethyl}-1H-indol-3-yl)methylidene]pyridine-4-carbohydrazide
Smiles: C=CCc1ccccc1OCCn1c2ccccc2c(c1C)/C=N/NC(=O)c1ccncc1

STK072463
Synonyms: 2,4-dichloro-N-[4-(pyridin-3-yloxy)phenyl]benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)Nc1ccc(cc1)Oc1cccnc1

STK072499
Synonyms: N-[3-(propan-2-yloxy)propyl]-N'-(pyridin-3-yl)butanediamide
Smiles: O=C(CCC(=O)Nc1cccnc1)NCCCOC(C)C

STK072553
Synonyms: 3-chloro-4-ethoxy-N-[(2-fluorophenyl)carbamothioyl]benzamide
Smiles: CCOc1ccc(cc1Cl)C(=O)NC(=S)Nc1ccccc1F

STK072565
Synonyms: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(E)-(2-methyl-1H-indol-3-yl)methylidene]amino}benzenesulfonamide
Smiles: CCc1nnc(s1)NS(=O)(=O)c1ccc(cc1)/N=C/c1c(C)[nH]c2c1cccc2

STK072574
Synonyms: 1-methyl-1,2,3,4,5,7,8,9-octahydrocyclopenta[5,6]pyrido[2,3-b]azepin-6-amine
Smiles: CN1CCCCc2c1nc1CCCc1c2N

STK072578
Synonyms: ethyl4-(2-{4-[(3-chloro-2-methylphenyl)amino]-4-oxobutanoyl}hydrazinyl)-4-oxobutanoate
Smiles: Cc1c(NC(=O)CCC(=O)NNC(=O)CCC(=O)OCC)cccc1Cl

STK072582
Synonyms: 5-(diethylamino)-2-(1,3-diphenylimidazolidin-2-yl)phenol
Smiles: CCN(c1ccc(c(c1)O)C1N(CCN1c1ccccc1)c1ccccc1)CC

STK072584
Synonyms: 5-methyl-1-(4-methylphenyl)-1H-tetrazole
Smiles: Cc1ccc(cc1)n1nnnc1C

STK072597
Synonyms: N'-[bis(4-methoxyphenyl)methylidene]pyridine-2-carbohydrazide
Smiles: COc1ccc(cc1)/C(=N/NC(=O)c1ccccn1)/c1ccc(cc1)OC

STK072641
Synonyms: 4-{[4-(piperidin-1-ylcarbonyl)-2-(prop-2-en-1-yl)phenoxy]methyl}benzoicacid
Smiles: C=CCc1cc(ccc1OCc1ccc(cc1)C(=O)O)C(=O)N1CCCCC1

STK072647
Synonyms: N-(pyridin-3-yl)-N'-[3-(trifluoromethyl)phenyl]pentanediamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CCCC(=O)Nc1cccnc1

STK072670
Synonyms: ethyl4-[(4Z)-4-[3-methoxy-4-(prop-2-en-1-yloxy)benzylidene]-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]benzoate
Smiles: C=CCOc1ccc(cc1OC)/C=C/1\C(=O)N(N=C1C(F)(F)F)c1ccc(cc1)C(=O)OCC

STK072686
Synonyms: 2,2,3,3-tetrafluoropropyl4-[(3-fluorophenyl)amino]-4-oxobutanoate
Smiles: O=C(OCC(C(F)F)(F)F)CCC(=O)Nc1cccc(c1)F

STK072696
Synonyms: N-(2,6-dimethylphenyl)-1-[(1H-indol-3-ylacetyl)amino]cyclohexanecarboxamide
Smiles: O=C(NC1(CCCCC1)C(=O)Nc1c(C)cccc1C)Cc1c[nH]c2c1cccc2

STK072716
Synonyms: N-[1-(4-fluorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-(4-sulfamoylbenzyl)acetamide
Smiles: Fc1ccc(cc1)N1C(=O)CC(C1=O)N(C(=O)C)Cc1ccc(cc1)S(=O)(=O)N

STK072729
Synonyms: ethyl5,5-dimethyl-2-{[4-(morpholin-4-yl)butanoyl]amino}-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CCCN2CCOCC2)sc2c1CC(C)(C)OC2

STK072747
Synonyms: methanediylbis(triphenylphosphonium)
Smiles: c1ccc(cc1)[P+](c1ccccc1)(c1ccccc1)C[P+](c1ccccc1)(c1ccccc1)c1ccccc1

STK072757
Synonyms: (2Z)-2,3-dimethyl-4-oxo-4-[(2-phenylethyl)amino]but-2-enoicacid
Smiles: O=C(/C(=C(\C(=O)O)/C)/C)NCCc1ccccc1

STK072777
Synonyms: 2,6-bis(2-fluorophenyl)-8,10-dimethyl-1,3,5,7-tetraoxododecahydro-4,8-ethenopyrrolo[3,4-f]isoindol-9-ylpropanoate
Smiles: CCC(=O)OC1=C(C)C2C3C(C1(C)C1C2C(=O)N(C1=O)c1ccccc1F)C(=O)N(C3=O)c1ccccc1F

STK072802
Synonyms: 1-(4-ethylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCc1ccc(cc1)N1C(=O)CC(=O)NC1=S

STK072804
Synonyms: 1H-benzotriazol-1-yl(3,4-dimethylphenyl)methanone
Smiles: Cc1ccc(cc1C)C(=O)n1nnc2c1cccc2

STK072806
Synonyms: N-[2-(piperazin-1-yl)ethyl]-N'-(propan-2-yl)ethanediamide
Smiles: CC(NC(=O)C(=O)NCCN1CCNCC1)C

STK072849
Synonyms: 4-amino-3-methyl-3-phenylbutanoicacid
Smiles: NCC(c1ccccc1)(CC(=O)O)C

STK072874
Synonyms: 2-hydroxy-6-(2-methylpropyl)-4-phenylpyridine-3-carbonitrile
Smiles: N#Cc1c(O)nc(cc1c1ccccc1)CC(C)C

STK072892
Synonyms: 6-methoxy-2-methyl-4-(piperidin-1-yl)quinoline
Smiles: COc1ccc2c(c1)c(cc(n2)C)N1CCCCC1

STK072910
Synonyms: S-{2-oxo-2-[(2,4,6-trimethylphenyl)amino]ethyl}carbamothioate
Smiles: O=C(Nc1c(C)cc(cc1C)C)CSC(=O)N

STK072913
Synonyms: {[6,6-dimethyl-5-(morpholin-4-yl)-3,6-dihydro-2H-pyran-4-yl]methylidene}propanedinitrile
Smiles: N#CC(=CC1=C(N2CCOCC2)C(OCC1)(C)C)C#N

STK072916
Synonyms: (2Z)-6,8-dichloro-2-[(2,3-dimethylphenyl)imino]-N-(4-phenyl-1,3-thiazol-2-yl)-2H-chromene-3-carboxamide
Smiles: Clc1cc(Cl)c2c(c1)cc(/c(=N/c1cccc(c1C)C)/o2)C(=O)Nc1scc(n1)c1ccccc1

STK072927
Synonyms: 2-[(2,4-dimethylbenzyl)sulfanyl]-3-(2-methylprop-2-en-1-yl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: Cc1ccc(c(c1)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3

STK072968
Synonyms: (5Z)-5-{4-[(3-chlorobenzyl)oxy]-3-ethoxybenzylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCOc1cc(ccc1OCc1cccc(c1)Cl)/C=C/1\SC(=S)NC1=O

STK072974
Synonyms: 4,6-dimethyl-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]pyrimidin-2-amine
Smiles: Cc1ccc(cc1)c1csc(n1)Nc1nc(C)cc(n1)C

STK073013
Synonyms: 4-(morpholin-4-yl)-5-nitrospiro[benzimidazole-2,1'-cyclohexane]1-oxide
Smiles: [O-][N+](=O)c1ccc2=[N+](C3(N=c2c1N1CCOCC1)CCCCC3)[O-]

STK073022
Synonyms: N-[2-(dimethylamino)ethyl]-1-[(2E)-3-phenylprop-2-en-1-yl]piperidine-4-carboxamide
Smiles: CN(CCNC(=O)C1CCN(CC1)C/C=C/c1ccccc1)C

STK073031
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}benzamide
Smiles: CCc1c(C)nc2n(c1=O)nc(s2)Sc1nnc(s1)NC(=O)c1ccccc1

STK073080
Synonyms: 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-(thiophen-2-yl)pyridine-3-carbonitrile
Smiles: N#Cc1ccc(nc1SCc1nc2c([nH]1)cccc2)c1cccs1

STK073086
Synonyms: (4Z)-5-methyl-4-[2-(2-methyl-3-nitrophenyl)hydrazinylidene]-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC1=NN(C(=O)/C/1=N\Nc1cccc(c1C)[N+](=O)[O-])c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK073100
Synonyms: (2E)-1-(4-chlorophenyl)-3-[(2-hydroxyphenyl)amino]prop-2-en-1-one
Smiles: Clc1ccc(cc1)C(=O)/C=C/Nc1ccccc1O

STK073103
Synonyms: 4-(4-chlorophenyl)-2-[4-(ethoxycarbonyl)-5-methyl-1H-pyrrol-2-yl]-4-oxobutanoicacid
Smiles: CCOC(=O)c1cc([nH]c1C)C(C(=O)O)CC(=O)c1ccc(cc1)Cl

STK073112
Synonyms: N-cyclohexyl-2-[(E)-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: O=C(c1c(/C=C/c2ccc3c(c2)n(C)c(=O)n3C)sc2c1CCCC2)NC1CCCCC1

STK073125
Synonyms: 2-(3-butyl-2-imino-2,3-dihydro-1H-benzimidazol-1-yl)-1-(4-methoxyphenyl)ethanone
Smiles: CCCCn1c(=N)n(c2c1cccc2)CC(=O)c1ccc(cc1)OC

STK073130
Synonyms: N-[(E)-(4-bromophenyl)methylidene]-4-(trifluoromethoxy)aniline
Smiles: FC(Oc1ccc(cc1)/N=C/c1ccc(cc1)Br)(F)F

STK073145
Synonyms: N-[(E)-{3-[(4-fluorobenzyl)oxy]phenyl}methylidene]-4H-1,2,4-triazol-4-amine
Smiles: Fc1ccc(cc1)COc1cccc(c1)/C=N/n1cnnc1

STK073153
Synonyms: (5,6-dimethyl-1H-benzimidazol-1-yl)(3-iodophenyl)methanone
Smiles: Ic1cccc(c1)C(=O)n1cnc2c1cc(C)c(c2)C

STK073168
Synonyms: 2-[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propanoyl]-N-(2,4,4-trimethylpentan-2-yl)hydrazinecarbothioamide
Smiles: O=C(CCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)NNC(=S)NC(CC(C)(C)C)(C)C

STK073181
Synonyms: 5-bromo-N'-[(2E,3E,5E)-6-phenylhexa-3,5-dien-2-ylidene]pyridine-3-carbohydrazide
Smiles: Brc1cncc(c1)C(=O)N/N=C(/C=C/C=C/c1ccccc1)\C

STK073183
Synonyms: N-(4-hydroxy-2-oxo-1,2-dihydroquinolin-3-yl)-N'-(3-methylbutyl)ethanediamide
Smiles: CC(CCNC(=O)C(=O)Nc1c(=O)[nH]c2c(c1O)cccc2)C

STK073189
Synonyms: 2-(2-amino[1,3]thiazolo[4,3-b][1,3,4]thiadiazol-5-yl)-4-nitrophenol
Smiles: [O-][N+](=O)c1cc(C2SC=c3n2nc(s3)N)c(cc1)O

STK073207
Synonyms:
Smiles: Nc1ncn(c2c1nc([nH]2)SCc1ccccc1)Cc1ccccc1

STK073217
Synonyms: 1-[3-(4-fluorophenyl)-3-oxo-2-(2-oxopyridin-1(2H)-yl)propanoyl]-N-[3-(1H-imidazol-1-yl)propyl]piperidine-4-carboxamide
Smiles: Fc1ccc(cc1)C(=O)C(n1ccccc1=O)C(=O)N1CCC(CC1)C(=O)NCCCn1ccnc1

STK073218
Synonyms: N-[2-(diethylamino)ethyl]-2-(quinoxalin-6-yloxy)acetamide
Smiles: CCN(CCNC(=O)COc1ccc2c(c1)nccn2)CC

STK073227
Synonyms: ethyl{(5E)-5-[(7-methoxy-1,3-benzodioxol-5-yl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}acetate
Smiles: CCOC(=O)CN1C(=O)S/C(=C/c2cc(OC)c3c(c2)OCO3)/C1=O

STK073237
Synonyms: methyl4-cyano-4-(3,4-dimethoxyphenyl)cyclohexanecarboxylate
Smiles: COC(=O)C1CCC(CC1)(C#N)c1ccc(c(c1)OC)OC

STK073238
Synonyms: [4-(dipropan-2-ylamino)-1,1-dioxido-2H-1,2-benzothiazin-3-yl](phenyl)methanone
Smiles: CC(N(C1=C(NS(=O)(=O)c2c1cccc2)C(=O)c1ccccc1)C(C)C)C

STK073242
Synonyms: 2-{[2-amino-5-cyano-6-(methylsulfanyl)pyrimidin-4-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2nccs2)nc(nc1SC)N

STK073246
Synonyms: 2-(dibutylamino)ethylhydroxy(diphenyl)acetate
Smiles: CCCCN(CCCC)CCOC(=O)C(c1ccccc1)(c1ccccc1)O

STK073278
Synonyms: chloro(1H-indol-3-yl)mercury
Smiles: Cl[Hg]c1c[nH]c2c1cccc2

STK073293
Synonyms: 4-{[(2-oxo-1,3-benzoxazol-3(2H)-yl)methyl]amino}benzoicacid
Smiles: OC(=O)c1ccc(cc1)NCn1c(=O)oc2c1cccc2

STK073294
Synonyms: (6E)-6-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3,5-dimethoxybenzylidene)-5-imino-2-(2-methylphenyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCC(c1ccc(cc1)OCCOc1c(OC)cc(cc1OC)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)c1ccccc1C)C

STK073299
Synonyms: methyl1-ethenyl-1H-pyrazole-3-carboxylate
Smiles: COC(=O)c1ccn(n1)C=C

STK073304
Synonyms: N-{2-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]propanoyl}-D-alanine
Smiles: O=C(C(Oc1ccc2c(c1)oc(=O)cc2C)C)N[C@@H](C(=O)O)C

STK073311
Synonyms: 6-(4-chlorophenyl)-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}pyridine-3-carbonitrile
Smiles: N#Cc1ccc(nc1SCC(=O)N1CCCCC1)c1ccc(cc1)Cl

STK073330
Synonyms: 2-(3,4-dimethoxyphenyl)-N-(4-fluorobenzyl)-N-methylethanamine
Smiles: COc1cc(CCN(Cc2ccc(cc2)F)C)ccc1OC

STK073331
Synonyms: 2,6-bis[4-(pentyloxy)phenyl]pyraniumperchlorate
Smiles: [O-][Cl](=O)(=O)=O.CCCCCOc1ccc(cc1)c1cccc([o+]1)c1ccc(cc1)OCCCCC

STK073346
Synonyms: 2-(4-chloro-3-methylphenoxy)-1-(pyrrolidin-1-yl)ethanone
Smiles: O=C(N1CCCC1)COc1ccc(c(c1)C)Cl

STK073357
Synonyms: 3-chloro-4-ethoxy-N-[(2-methoxyphenyl)carbamothioyl]benzamide
Smiles: CCOc1ccc(cc1Cl)C(=O)NC(=S)Nc1ccccc1OC

STK073376
Synonyms: 3-[(4-chlorobenzyl)sulfanyl]-4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazole
Smiles: CCn1c(SCc2ccc(cc2)Cl)nnc1c1ccc(cc1)C

STK073400
Synonyms: 2-chloro-5-({[(3-chloro-4-ethoxyphenyl)carbonyl]carbamothioyl}amino)benzoicacid
Smiles: CCOc1ccc(cc1Cl)C(=O)NC(=S)Nc1ccc(c(c1)C(=O)O)Cl

STK073401
Synonyms: [3-(4-fluorophenyl)-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl](4-nitrophenyl)methanone
Smiles: Fc1ccc(cc1)C1=NN(C(C1)(O)C(F)(F)F)C(=O)c1ccc(cc1)[N+](=O)[O-]

STK073460
Synonyms: N-(3-hydroxy-4,5-dimethoxyphenyl)tricyclo[3.3.1.1~3,7~]decane-1-carboxamide-ethane(1:1)
Smiles: COc1c(O)cc(cc1OC)NC(=O)C12CC3CC(C2)CC(C1)C3.CC

STK073485
Synonyms: N-[(Z)-[(6-ethoxy-4-methylquinazolin-2-yl)amino]{[(4-methylphenyl)carbonyl]amino}methylidene]-4-methylbenzamide
Smiles: CCOc1ccc2c(c1)c(C)nc(n2)N/C(=N/C(=O)c1ccc(cc1)C)/NC(=O)c1ccc(cc1)C

STK073494
Synonyms: 4-(2-{(Z)-[3-methyl-5-oxo-1-(4-sulfamoylphenyl)-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-1H-pyrrol-1-yl)benzenesulfonamide
Smiles: CC1=NN(C(=O)/C/1=C\c1cccn1c1ccc(cc1)S(=O)(=O)N)c1ccc(cc1)S(=O)(=O)N

STK073504
Synonyms: 2-{[(2E)-3-(4-nitrophenyl)prop-2-enoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: O=C(Nc1sc2c(c1C(=O)N)CCCC2)/C=C/c1ccc(cc1)[N+](=O)[O-]

STK073507
Synonyms: 6,6-dimethyl-5-oxo-2-thioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#Cc1cc2c([nH]c1=S)CCC(C2=O)(C)C

STK073557
Synonyms: hexaethyl2,2',2''-(1,3,5-triazine-2,4,6-triyl)tris(nitropropanedioate)
Smiles: CCOC(=O)C(c1nc(nc(n1)C(C(=O)OCC)(C(=O)OCC)[N+](=O)[O-])C(C(=O)OCC)(C(=O)OCC)[N+](=O)[O-])(C(=O)OCC)[N+](=O)[O-]

STK073559
Synonyms: [(4E)-2,6-dimethyl-4-(2-phenylhydrazinylidene)-3,4-dihydroquinolin-1(2H)-yl](phenyl)methanone
Smiles: Cc1ccc2c(c1)/C(=N/Nc1ccccc1)/CC(N2C(=O)c1ccccc1)C

STK073564
Synonyms: N-(1-methoxypropan-2-yl)-1-(pyridin-2-ylmethyl)piperidine-4-carboxamide
Smiles: COCC(NC(=O)C1CCN(CC1)Cc1ccccn1)C

STK073566
Synonyms: 2-{[(2-bromophenyl)carbonyl]amino}-N-(4-ethoxyphenyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: CCOc1ccc(cc1)NC(=O)c1c(sc2c1CCC(C2)C)NC(=O)c1ccccc1Br

STK073574
Synonyms: 1,1'-[(Z)-1,2-dibromoethene-1,2-diyl]bis(4-bromobenzene)
Smiles: Br/C(=C(/c1ccc(cc1)Br)\Br)/c1ccc(cc1)Br

STK073587
Synonyms: 4-methyl-N-(4'-nitrobiphenyl-4-yl)benzamide
Smiles: Cc1ccc(cc1)C(=O)Nc1ccc(cc1)c1ccc(cc1)[N+](=O)[O-]

STK073608
Synonyms: 5-methyl-5-phenyl-1,3-bis(2,4,4-trimethylpentan-2-yl)-1,3,5-diazaphosphinan-5-ium
Smiles: CC(CC(N1CN(C[P+](C1)(C)c1ccccc1)C(CC(C)(C)C)(C)C)(C)C)(C)C

STK073620
Synonyms: 2-(2,5-dimethyl-1H-indol-3-yl)-N-[3-(morpholin-4-yl)propyl]acetamide
Smiles: O=C(Cc1c(C)[nH]c2c1cc(C)cc2)NCCCN1CCOCC1

STK073632
Synonyms: 4-{(Z)-[(2Z)-3-benzyl-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)/C=C/1\S/C(=N\c2ccccc2)/N(C1=O)Cc1ccccc1

STK073640
Synonyms: N-{(E)-amino[(4,7-dimethylquinazolin-2-yl)amino]methylidene}propanamide
Smiles: CCC(=O)/N=C(/Nc1nc(C)c2c(n1)cc(cc2)C)\N

STK073649
Synonyms: 2-[(cyclohexylcarbamoyl)amino]benzoicacid
Smiles: O=C(Nc1ccccc1C(=O)O)NC1CCCCC1

STK073650
Synonyms: (6Z)-6-(4-{2-[(4-chlorophenyl)sulfanyl]ethoxy}-3-ethoxybenzylidene)-5-imino-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Smiles: CCOc1cc(ccc1OCCSc1ccc(cc1)Cl)/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1

STK073656
Synonyms: N-[2-(dimethylamino)ethyl]-3-(3-nitrophenyl)-3-oxo-2-(2-oxopyridin-1(2H)-yl)propanamide
Smiles: CN(CCNC(=O)C(n1ccccc1=O)C(=O)c1cccc(c1)[N+](=O)[O-])C

STK073666
Synonyms: N-(1-methoxypropan-2-yl)-1-[4-(propan-2-yl)benzyl]piperidine-4-carboxamide
Smiles: COCC(NC(=O)C1CCN(CC1)Cc1ccc(cc1)C(C)C)C

STK073673
Synonyms: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: Brc1ccc(cc1)C(=O)CSc1nc2sc3c(c2c(=O)n1C)CCCC3

STK073677
Synonyms: 2-{[(E)-(2,3-dihydroxyphenyl)methylidene]amino}benzonitrile
Smiles: N#Cc1ccccc1/N=C/c1cccc(c1O)O

STK073703
Synonyms: 1-(1-methyl-1H-benzimidazol-2-yl)-1-phenyl-2-(thiophen-2-yl)ethane-1,2-diol
Smiles: Cn1c2ccccc2nc1C(C(c1cccs1)O)(c1ccccc1)O

STK073725
Synonyms: ethyl4-({[5-(2,3-dichlorophenyl)furan-2-yl]carbonyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)c1ccc(o1)c1cccc(c1Cl)Cl

STK073729
Synonyms: (6Z)-6-{3-bromo-5-ethoxy-4-[2-(2-methylphenoxy)ethoxy]benzylidene}-5-imino-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Smiles: CCOc1cc(cc(c1OCCOc1ccccc1C)Br)/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1

STK073769
Synonyms: (2E)-3-(3-bromo-4,5-dimethoxyphenyl)-2-cyano-N-cyclopentylprop-2-enamide
Smiles: N#C/C(=C\c1cc(Br)c(c(c1)OC)OC)/C(=O)NC1CCCC1

STK073774
Synonyms: N-(2-hydroxyethyl)-2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonamide
Smiles: OCCNS(=O)(=O)c1ccc2c(c1)[nH]c(=O)[nH]2

STK073802
Synonyms: N,N-dimethyl-2-[(2-phenyl[1]benzofuro[3,2-d]pyrimidin-4-yl)oxy]ethanamine
Smiles: CN(CCOc1nc(nc2c1oc1c2cccc1)c1ccccc1)C

STK073847
Synonyms: 1-(4-bromocyclopenta-1,3-dien-1-yl)ethanone
Smiles: CC(=O)C1=CC=C(C1)Br

STK073849
Synonyms: 2-[(8-methoxy-4-methylquinazolin-2-yl)amino]pyrimidine-4,6-diol
Smiles: COc1cccc2c1nc(Nc1nc(O)cc(n1)O)nc2C

STK073864
Synonyms: 2-{[N-(2-fluorophenyl)-N-(methylsulfonyl)glycyl]amino}benzamide
Smiles: O=C(CN(S(=O)(=O)C)c1ccccc1F)Nc1ccccc1C(=O)N

STK073889
Synonyms: (4E)-4-(4-methylpent-3-en-1-ylidene)cyclohexane-1,2-dicarboxylicacid
Smiles: CC(=CC/C=C/1\CCC(C(C1)C(=O)O)C(=O)O)C

STK073890
Synonyms: 7-[2-hydroxy-3-(naphthalen-1-yloxy)propyl]-3-methyl-8-(morpholin-4-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCOCC1)COc1cccc2c1cccc2

STK073928
Synonyms: 2-[4-(6-bromo-4-phenylquinolin-2-yl)phenoxy]-N'-[(E)-(3,4-dimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)COc2ccc(cc2)c2nc3ccc(cc3c(c2)c2ccccc2)Br)ccc1OC

STK073956
Synonyms: ethyl4-{[(2-ethoxy-2-oxoethyl)carbamothioyl]amino}benzoate
Smiles: CCOC(=O)CNC(=S)Nc1ccc(cc1)C(=O)OCC

STK073997
Synonyms: 3-[(cyclohexylmethyl)amino]-1-(4-phenoxyphenyl)pyrrolidine-2,5-dione
Smiles: O=C1CC(C(=O)N1c1ccc(cc1)Oc1ccccc1)NCC1CCCCC1

STK074007
Synonyms: N-(3-ethoxypropyl)-1-(3-methylbutyl)piperidine-4-carboxamide
Smiles: CCOCCCNC(=O)C1CCN(CC1)CCC(C)C

STK074024
Synonyms: 1-(3-methoxybenzyl)-N-(1-methoxypropan-2-yl)piperidine-4-carboxamide
Smiles: COCC(NC(=O)C1CCN(CC1)Cc1cccc(c1)OC)C

STK074041
Synonyms: 2-(thiophen-2-yl)quinoline
Smiles: c1csc(c1)c1ccc2c(n1)cccc2

STK074049
Synonyms: 3-butyl-5-[4-(4-propylcyclohexyl)phenyl]-1,2,4-oxadiazole
Smiles: CCCCc1noc(n1)c1ccc(cc1)C1CCC(CC1)CCC

STK074057
Synonyms: 2,5-di(pyridin-3-yl)[1,3]thiazolo[5,4-d][1,3]thiazole
Smiles: c1ccc(cn1)c1nc2c(s1)nc(s2)c1cccnc1

STK074072
Synonyms: 7-[3-(4-bromophenoxy)-2-hydroxypropyl]-3-methyl-8-sulfanyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(S)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)Br

STK074078
Synonyms: N-{4-[(3,5-diphenyl-1H-pyrazol-1-yl)carbonyl]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)C(=O)n1nc(cc1c1ccccc1)c1ccccc1

STK074111
Synonyms: 4-[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-6-(piperidin-1-yl)-N-(prop-2-en-1-yl)-1,3,5-triazin-2-amine
Smiles: C=CCNc1nc(nc(n1)N1CCCCC1)OC(C(F)(F)F)C(F)(F)F

STK074222
Synonyms: 5-imino-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carbonitrile
Smiles: N=c1c(cnc2n1ccs2)C#N

STK074228
Synonyms: N-(3-methoxynaphthalen-1-yl)-2,1,3-benzothiadiazole-4-sulfonamide
Smiles: COc1cc2ccccc2c(c1)NS(=O)(=O)c1cccc2c1nsn2

STK074230
Synonyms: N-[4-({[(4-fluorophenyl)carbonyl]carbamothioyl}amino)phenyl]thiophene-2-carboxamide
Smiles: S=C(NC(=O)c1ccc(cc1)F)Nc1ccc(cc1)NC(=O)c1cccs1

STK074233
Synonyms: ethyl4-({4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}amino)-4-oxobutanoate
Smiles: CCOC(=O)CCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nc(C)cc(n1)C

STK074246
Synonyms: 1-[3-(benzyloxy)benzyl]azepane
Smiles: C1CCCN(CC1)Cc1cccc(c1)OCc1ccccc1

STK074255
Synonyms: N-{(E)-amino[(4,6-dimethylquinazolin-2-yl)amino]methylidene}acetamide
Smiles: Cc1ccc2c(c1)c(C)nc(n2)N/C(=N/C(=O)C)/N

STK074290
Synonyms: 1-[3-hydroxy-3-(trifluoromethyl)-3a,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-2(3H)-yl]-2-methylpropan-1-one
Smiles: CC(C(=O)N1N=C2C(C1(O)C(F)(F)F)CCCCC2)C

STK074301
Synonyms: 3-{(E)-[(4-nitrophenyl)imino]methyl}benzene-1,2-diol
Smiles: [O-][N+](=O)c1ccc(cc1)/N=C/c1cccc(c1O)O

STK074303
Synonyms: 3-chloro-6-[(2E)-2-(4-ethylbenzylidene)hydrazinyl]pyridazine
Smiles: CCc1ccc(cc1)/C=N/Nc1ccc(nn1)Cl

STK074338
Synonyms: 2-(dimethylcarbamoyl)phenylacetate
Smiles: CC(=O)Oc1ccccc1C(=O)N(C)C

STK074384
Synonyms: 4-(2-chloro-4-{[(3,5-dibromo-2-hydroxyphenyl)carbonyl]amino}phenyl)-N,N-diethylpiperazine-1-carboxamide
Smiles: CCN(C(=O)N1CCN(CC1)c1ccc(cc1Cl)NC(=O)c1cc(Br)cc(c1O)Br)CC

STK074415
Synonyms: 1-{2-[4-(dimethylamino)phenyl]-1-hydroxy-4-methyl-1H-imidazol-5-yl}ethanone
Smiles: CN(c1ccc(cc1)c1nc(c(n1O)C(=O)C)C)C

STK074418
Synonyms: [2-(4-chlorophenyl)-4-(4-ethylphenyl)-1,3-thiazol-5-yl]aceticacid
Smiles: CCc1ccc(cc1)c1nc(sc1CC(=O)O)c1ccc(cc1)Cl

STK074421
Synonyms: N'-{(3E)-1-[(dipropylamino)methyl]-2-oxo-1,2-dihydro-3H-indol-3-ylidene}-2-({[(1E)-1-(thiophen-2-yl)ethylidene]amino}oxy)acetohydrazide
Smiles: CCCN(CN1C(=O)/C(=N/NC(=O)CO/N=C(/c2cccs2)\C)/c2c1cccc2)CCC

STK074461
Synonyms: 8-[(furan-2-ylmethyl)amino]-1,3-dimethyl-7-(naphthalen-2-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)n(C)c2c(c1=O)n(Cc1ccc3c(c1)cccc3)c(n2)NCc1ccco1

STK074462
Synonyms: 2-oxo-2-{[3-(trifluoromethyl)phenyl]amino}ethylcarbamimidothioate
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CSC(=N)N

STK074475
Synonyms: 2,4,5,6,7-pentaphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
Smiles: O=C1N(c2ccccc2)C(=O)C2C1C1(c3ccccc3)C(=C(C2(C1=O)c1ccccc1)c1ccccc1)c1ccccc1

STK074509
Synonyms: 1-[3-(thiophen-2-yl)-4-oxa-1,2-diazaspiro[4.4]non-2-en-1-yl]ethanone
Smiles: CC(=O)N1N=C(OC21CCCC2)c1cccs1

STK074520
Synonyms: 2-[4-(prop-2-en-1-yloxy)phenoxy]acetamide
Smiles: C=CCOc1ccc(cc1)OCC(=O)N

STK074538
Synonyms: 1-cyclopropylethylacetate
Smiles: CC(C1CC1)OC(=O)C

STK074551
Synonyms: 4-benzyl-N-(3-phenoxybenzylidene)piperazin-1-amine
Smiles: c1ccc(cc1)CN1CCN(CC1)/N=C/c1cccc(c1)Oc1ccccc1

STK074553
Synonyms: N,N,N'-trimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine
Smiles: CNc1nc(OCC(F)(F)F)nc(n1)N(C)C

STK074573
Synonyms: N-methyl-N-(naphthalen-1-ylmethyl)butan-1-amine
Smiles: CCCCN(Cc1cccc2c1cccc2)C

STK074577
Synonyms: N-(2-chlorophenyl)-2-methoxyacetamide
Smiles: COCC(=O)Nc1ccccc1Cl

STK074586
Synonyms: N-[(E)-(4-methoxyphenyl)methylidene]-4-(6-methyl-1,3-benzothiazol-2-yl)aniline
Smiles: COc1ccc(cc1)/C=N/c1ccc(cc1)c1nc2c(s1)cc(cc2)C

STK074599
Synonyms: 4-(quinolin-2-yl)phenol
Smiles: Oc1ccc(cc1)c1ccc2c(n1)cccc2

STK074606
Synonyms: 6-phenyl-2-[(E)-2-phenylethenyl]pyrimidin-4(1H)-one
Smiles: O=c1nc(/C=C/c2ccccc2)[nH]c(c1)c1ccccc1

STK074607
Synonyms: 8-[(2-hydroxyethyl)sulfanyl]-7-[2-hydroxy-3-(naphthalen-1-yloxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCSc1nc2c(n1CC(COc1cccc3c1cccc3)O)c(=O)[nH]c(=O)n2C

STK074620
Synonyms: (5E)-5-(hydroxyimino)-5-(1H-indol-3-yl)pentanoicacid
Smiles: O/N=C(/c1c[nH]c2c1cccc2)\CCCC(=O)O

STK074628
Synonyms:
Smiles: COc1c2C=[N](C)CCc2cc2c1OCO2

STK074642
Synonyms: 2-(4-propoxybenzyl)propanedihydrazide
Smiles: CCCOc1ccc(cc1)CC(C(=O)NN)C(=O)NN

STK074644
Synonyms: 1-(4-fluorobenzyl)pyrrolidine
Smiles: Fc1ccc(cc1)CN1CCCC1

STK074655
Synonyms: 2-({[(3Z)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]amino}oxy)acetamide
Smiles: NC(=O)CO/N=C/1\C(=O)Nc2c1cccc2

STK074663
Synonyms: 3-[5-(4'-pentylbiphenyl-4-yl)-1,2,4-oxadiazol-3-yl]pyridine
Smiles: CCCCCc1ccc(cc1)c1ccc(cc1)c1onc(n1)c1cccnc1

STK074681
Synonyms: N-[3-(dimethylamino)-2,2-dimethylpropyl]-1-(naphthalen-1-ylmethyl)piperidine-4-carboxamide
Smiles: CN(CC(CNC(=O)C1CCN(CC1)Cc1cccc2c1cccc2)(C)C)C

STK074684
Synonyms: 2-[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]pyridine-3-carboxylicacid
Smiles: OC(=O)c1cccnc1N/N=C/c1ccc2c(c1)OCO2

STK074687
Synonyms: 1-(morpholin-4-yl)-2-(10H-phenothiazin-10-yl)ethanone
Smiles: O=C(N1CCOCC1)CN1c2ccccc2Sc2c1cccc2

STK074702
Synonyms: (2E)-N-[2-(dimethylamino)ethyl]-3-(4-methylphenyl)-2-(2-oxopyridin-1(2H)-yl)prop-2-enamide
Smiles: CN(CCNC(=O)/C(=C\c1ccc(cc1)C)/n1ccccc1=O)C

STK074704
Synonyms: (6Z)-6-{3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-ethoxybenzylidene}-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)Br)/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1

STK074730
Synonyms: (2E)-N-benzyl-2-cyano-3-{3-ethoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl}prop-2-enamide
Smiles: CCOc1cc(ccc1OCCOc1ccccc1C)/C=C(/C(=O)NCc1ccccc1)\C#N

STK074738
Synonyms: N-ethyl-2-methyl-N-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]prop-2-en-1-amine
Smiles: CCN(Cc1c(nc2n1ccs2)c1ccccc1)CC(=C)C

STK074753
Synonyms: diethyl{2-[(2E)-2-{3-[(2,4-difluorophenoxy)methyl]-4-methoxybenzylidene}hydrazinyl]-2-oxoethyl}phosphonate
Smiles: CCOP(=O)(CC(=O)N/N=C/c1ccc(c(c1)COc1ccc(cc1F)F)OC)OCC

STK074763
Synonyms: 1-(4-fluorobenzyl)-5-hydroxy-3,4-dimethyl-1,5-dihydro-2H-pyrrol-2-one
Smiles: Fc1ccc(cc1)CN1C(=O)C(=C(C1O)C)C

STK074782
Synonyms: 3-hydroxy-6,8a-dimethyl-3-(propan-2-yl)-1,2,3,3a,4,5,8,8a-octahydroazulen-4-yl3,4-dimethoxybenzoate
Smiles: COc1ccc(cc1OC)C(=O)OC1CC(=CCC2(C1C(O)(CC2)C(C)C)C)C

STK074791
Synonyms: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(4-phenyl-1H-imidazol-2-yl)sulfanyl]acetamide
Smiles: CCc1nnc(s1)NC(=O)CSc1[nH]cc(n1)c1ccccc1

STK074802
Synonyms: 4-tert-butyl-N-[2-(2,3-dichlorophenyl)-1,3-benzoxazol-5-yl]benzamide
Smiles: O=C(c1ccc(cc1)C(C)(C)C)Nc1ccc2c(c1)nc(o2)c1cccc(c1Cl)Cl

STK074810
Synonyms: 2-[(1Z)-2-(cyclohexylamino)-N-hydroxy-2-oxoethanimidoyl]-1-methylpyridinium
Smiles: O/N=C(/c1cccc[n+]1C)\C(=O)NC1CCCCC1

STK074813
Synonyms: morpholin-4-yl(5-phenoxy-1H-indol-2-yl)methanone
Smiles: O=C(c1cc2c([nH]1)ccc(c2)Oc1ccccc1)N1CCOCC1

STK074822
Synonyms: 2-{2-[2-(2-methoxyphenoxy)ethoxy]-5-nitrophenyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: COc1ccccc1OCCOc1ccc(cc1c1nc2sc3c(c2c(=O)[nH]1)CCCC3)[N+](=O)[O-]

STK074836
Synonyms: 3,4-dimethoxy-N-(1H-1,2,4-triazol-3-yl)benzamide
Smiles: COc1cc(ccc1OC)C(=O)Nc1n[nH]cn1

STK074841
Synonyms: [4-(4-methoxyphenyl)-2-(4-nitrophenyl)-1,3-thiazol-5-yl]aceticacid
Smiles: COc1ccc(cc1)c1nc(sc1CC(=O)O)c1ccc(cc1)[N+](=O)[O-]

STK074855
Synonyms: 8-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamoyl]naphthalene-1-carboxylicacid
Smiles: O=C(c1cccc2c1c(ccc2)C(=O)O)NC1CC(C)(C)NC(C1)(C)C

STK074861
Synonyms: 3-(3-methoxyphenyl)-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1c1cccc(c1)OC

STK074871
Synonyms: N-(3-chloro-2-methylphenyl)-4-oxo-4-[2-(phenylcarbamothioyl)hydrazinyl]butanamide
Smiles: O=C(NNC(=S)Nc1ccccc1)CCC(=O)Nc1cccc(c1C)Cl

STK074876
Synonyms: methyl(2Z)-(2-{[(3-chlorophenyl)carbonyl]amino}-4-oxo-1,3-thiazolidin-5-ylidene)ethanoate
Smiles: COC(=O)/C=C/1\SC(NC1=O)NC(=O)c1cccc(c1)Cl

STK074878
Synonyms: 5-(2-ethyl-1H-imidazol-1-yl)-5-oxopentanoicacid
Smiles: CCc1nccn1C(=O)CCCC(=O)O

STK074907
Synonyms: 2-chloro-N'-[(1Z,2E)-3-(4-methoxyphenyl)-1-phenylprop-2-en-1-ylidene]benzohydrazide
Smiles: COc1ccc(cc1)/C=C/C(=N/NC(=O)c1ccccc1Cl)/c1ccccc1

STK074922
Synonyms: [2-({[4-(diethylamino)phenyl]amino}methyl)phenyl]methanol
Smiles: CCN(c1ccc(cc1)NCc1ccccc1CO)CC

STK074925
Synonyms: ethyl{[2-(1-benzofuran-2-yl)-1H-indol-3-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1c([nH]c2c1cccc2)c1cc2c(o1)cccc2

STK074946
Synonyms: N-(naphthalen-2-ylsulfonyl)methionine
Smiles: CSCCC(C(=O)O)NS(=O)(=O)c1ccc2c(c1)cccc2

STK074964
Synonyms: 5-(4-chlorophenyl)-7-phenyl-1,5-dihydro-2H-pyrano[2,3-d]pyrimidine-2,4(3H)-dione
Smiles: Clc1ccc(cc1)C1C=C(Oc2c1c(=O)[nH]c(=O)[nH]2)c1ccccc1

STK074968
Synonyms: 1-(furan-2-yl)-3-[(4-iodophenyl)amino]propan-1-one
Smiles: Ic1ccc(cc1)NCCC(=O)c1ccco1

STK074979
Synonyms: N-benzyl-N-(pyridin-2-yl)-1,3-benzodioxole-5-carboxamide
Smiles: O=C(N(c1ccccn1)Cc1ccccc1)c1ccc2c(c1)OCO2

STK074998
Synonyms: 3-amino-4,6-dimethyl-N-(1-phenylethyl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: Cc1cc(C)c2c(n1)sc(c2N)C(=O)NC(c1ccccc1)C

STK075011
Synonyms: 2-({1-[1-(diphenylmethyl)-1H-tetrazol-5-yl]cyclohexyl}amino)ethanol
Smiles: OCCNC1(CCCCC1)c1nnnn1C(c1ccccc1)c1ccccc1

STK075053
Synonyms: (5Z)-3-(3,4-dichlorophenyl)-5-(2-hydroxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C\c2ccccc2O)/C(=O)N1c1ccc(c(c1)Cl)Cl

STK075060
Synonyms: 1-(4-chlorophenyl)-N-(naphthalen-1-yl)-5-oxopyrrolidine-3-carboxamide
Smiles: Clc1ccc(cc1)N1CC(CC1=O)C(=O)Nc1cccc2c1cccc2

STK075061
Synonyms: 2,5-dioxopyrrolidin-1-ylN-tritylalaninate
Smiles: CC(C(=O)ON1C(=O)CCC1=O)NC(c1ccccc1)(c1ccccc1)c1ccccc1

STK075067
Synonyms: 4,5-dihydroxy-1,3-dimethyl-4,5-diphenylimidazolidin-2-one
Smiles: CN1C(=O)N(C(C1(O)c1ccccc1)(O)c1ccccc1)C

STK075068
Synonyms: N-[2-(2-methyl-5-oxotetrahydrofuran-2-yl)-2-oxoethyl]pyridin-2-aminium
Smiles: O=C1CCC(O1)(C)C(=O)C[NH2+]c1ccccn1

STK075077
Synonyms: 5,5-dimethyl-2-[(phenylcarbamothioyl)amino]-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylicacid
Smiles: S=C(Nc1sc2c(c1C(=O)O)CC(OC2)(C)C)Nc1ccccc1

STK075082
Synonyms: methyl[(4-hydroxy-5,7-dimethylpyrido[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
Smiles: COC(=O)CSc1nc(O)c2c(n1)nc(cc2C)C

STK075090
Synonyms: 2-(4-bromophenyl)-N'-methyl-N'-phenylacetohydrazide
Smiles: O=C(NN(c1ccccc1)C)Cc1ccc(cc1)Br

STK075097
Synonyms: 4-hydroxy-N'-[(1E)-1-(4-hydroxy-2-oxo-1,2-dihydroquinolin-3-yl)ethylidene]-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydroquinoline-3-carbohydrazide
Smiles: C=CCn1c(=O)c(C(=O)N/N=C(/c2c(=O)[nH]c3c(c2O)cccc3)\C)c(c2c1cccc2)O

STK075099
Synonyms: 2-(4-methylphenoxy)-N-{[4-(pyridin-4-ylmethyl)phenyl]carbamothioyl}acetamide
Smiles: O=C(NC(=S)Nc1ccc(cc1)Cc1ccncc1)COc1ccc(cc1)C

STK075101
Synonyms: 2-{[2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-methylpyrimidin-4-yl]amino}ethanol
Smiles: OCCNc1cc(C)nc(n1)n1nc(cc1C)C

STK075130
Synonyms: 6-amino-1-benzyl-4-(2,3-dimethoxyphenyl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccc(c1OC)OC)c(C)nn2Cc1ccccc1

STK075136
Synonyms: 5-cyclohexylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)NC(=O)C1C1CCCCC1

STK075145
Synonyms: 6,6-dimethyl-2-(methylsulfanyl)-3-(prop-2-en-1-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-imine
Smiles: C=CCn1c(SC)nc2c(c1=N)c1CC(C)(C)OCc1s2

STK075146
Synonyms: N'-[(4-butoxyphenyl)carbonyl]-4'-pentylbiphenyl-4-carbohydrazide
Smiles: CCCCCc1ccc(cc1)c1ccc(cc1)C(=O)NNC(=O)c1ccc(cc1)OCCCC

STK075172
Synonyms: 2-[(3-butoxypropyl)carbamoyl]cyclohexanecarboxylicacid
Smiles: CCCCOCCCNC(=O)C1CCCCC1C(=O)O

STK075191
Synonyms: N-(4-cyanophenyl)-N'-(4-phenoxyphenyl)butanediamide
Smiles: N#Cc1ccc(cc1)NC(=O)CCC(=O)Nc1ccc(cc1)Oc1ccccc1

STK075204
Synonyms: N-cyclohexyl-N'-(3-methylbutyl)butanediamide
Smiles: CC(CCNC(=O)CCC(=O)NC1CCCCC1)C

STK075208
Synonyms: N-(2-ethylhexyl)-N'-(tetrahydrofuran-2-ylmethyl)butanediamide
Smiles: CCCCC(CNC(=O)CCC(=O)NCC1CCCO1)CC

STK075215
Synonyms: (4E)-4-{5-bromo-2-[2-(2,5-dimethylphenoxy)ethoxy]benzylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Brc1ccc(c(c1)/C=C/1\C(=NN(C1=O)c1ccccc1)C)OCCOc1cc(C)ccc1C

STK075216
Synonyms: 3-hydroxy-4-{(E)-[(4-nitrophenyl)imino]methyl}-N-phenylnaphthalene-2-carboxamide
Smiles: O=C(c1cc2ccccc2c(c1O)/C=N/c1ccc(cc1)[N+](=O)[O-])Nc1ccccc1

STK075247
Synonyms: 4-[3-(2-chloro-6-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-(pyridin-4-yl)quinoline
Smiles: Fc1cccc(c1c1noc(n1)c1cc(nc2c1cccc2)c1ccncc1)Cl

STK075249
Synonyms: [2-(2,4-dichlorophenoxy)ethyl](4,6-dimethylpyrimidin-2-yl)cyanamide
Smiles: N#CN(c1nc(C)cc(n1)C)CCOc1ccc(cc1Cl)Cl

STK075253
Synonyms: 3-[({[4-amino-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoicacid
Smiles: O=C(Nc1cccc(c1)C(=O)O)CSc1nnc(n1N)c1ccc(cc1)C

STK075268
Synonyms: 2-cyclohexyl-3-methoxy-2,3-dihydro-1H-isoindol-1-one
Smiles: COC1N(C2CCCCC2)C(=O)c2c1cccc2

STK075283
Synonyms: 2-amino-4-(3,4-dichlorophenyl)-7-methyl-5-oxo-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(c(c1)Cl)Cl)c(=O)[nH]c(c2)C

STK075291
Synonyms: [2-(3-methyl-1-phenyl-1H-1,2,4-triazol-5-yl)phenoxy]aceticacid
Smiles: OC(=O)COc1ccccc1c1nc(nn1c1ccccc1)C

STK075298
Synonyms: (5Z)-3-benzyl-5-{5-chloro-2-[3-(2-chlorophenoxy)propoxy]benzylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: Clc1ccc(c(c1)/C=C/1\SC(=S)N(C1=O)Cc1ccccc1)OCCCOc1ccccc1Cl

STK075305
Synonyms: (4-{[(E)-(3-chlorophenyl)methylidene]amino}phenyl)(phenyl)methanone
Smiles: Clc1cccc(c1)/C=N/c1ccc(cc1)C(=O)c1ccccc1

STK075306
Synonyms: (2E)-6-chloro-2-(6-chloro-4-methyl-3-oxo-1-benzothiophen-2(3H)-ylidene)-4-methyl-1-benzothiophen-3(2H)-one
Smiles: Clc1cc2S/C(=C\3/Sc4c(C3=O)c(C)cc(c4)Cl)/C(=O)c2c(c1)C

STK075319
Synonyms: 7-methyl-4-phenyl-2-oxabicyclo[2.2.1]heptan-3-one
Smiles: CC1C2CCC1(C(=O)O2)c1ccccc1

STK075322
Synonyms: 5-[({2-[4-(acetyloxy)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl}carbonyl)amino]benzene-1,3-dicarboxylicacid
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)c2c(C1=O)ccc(c2)C(=O)Nc1cc(cc(c1)C(=O)O)C(=O)O

STK075325
Synonyms: N,N'-[sulfonylbis(1,3-dioxo-1,3-dihydro-2H-isoindole-5,2-diyl)]dipyridine-3-carboxamide
Smiles: O=C1c2cc(ccc2C(=O)N1NC(=O)c1cccnc1)S(=O)(=O)c1ccc2c(c1)C(=O)N(C2=O)NC(=O)c1cccnc1

STK075332
Synonyms: methyl4,5-dimethoxy-2-{[(4-nitrophenyl)carbonyl]amino}benzoate
Smiles: COC(=O)c1cc(OC)c(cc1NC(=O)c1ccc(cc1)[N+](=O)[O-])OC

STK075334
Synonyms: 3-{[(6-chloro-1,3-benzodioxol-5-yl)methyl]sulfanyl}-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(SCc2cc3OCOc3cc2Cl)nc(c2c1CCCC2)C

STK075343
Synonyms: 2-({2-iodo-6-methoxy-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)benzonitrile
Smiles: COc1cc(/C=C/2\SC(=S)N(C2=O)C)cc(c1OCc1ccccc1C#N)I

STK075345
Synonyms: 3-(4-ethoxyphenyl)-2,2-diethyl-2,3-dihydroquinazolin-4(1H)-one
Smiles: CCOc1ccc(cc1)N1C(=O)c2ccccc2NC1(CC)CC

STK075351
Synonyms: 2-(benzylsulfanyl)-6-ethyl-7-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Smiles: CCc1c(C)nc2n(c1=O)nc(s2)SCc1ccccc1

STK075394
Synonyms: 1-phenyl-3-[4-(phenylamino)phenyl]thiourea
Smiles: S=C(Nc1ccccc1)Nc1ccc(cc1)Nc1ccccc1

STK075418
Synonyms: 1-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4-(phenylcarbonyl)-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Clc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2C(=O)c1ccccc1)CCC3

STK075428
Synonyms: N-{1-[(3-bromo-4-methylphenyl)carbamoyl]cyclohexyl}-4-chloro-N-(furan-2-ylmethyl)benzamide
Smiles: Clc1ccc(cc1)C(=O)N(C1(CCCCC1)C(=O)Nc1ccc(c(c1)Br)C)Cc1ccco1

STK075430
Synonyms: (4Z)-4-[2-(2,5-dimethoxyphenyl)hydrazinylidene]-5-methyl-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1ccc(c(c1)N/N=C\1/C(=NN(C1=O)c1scc(n1)c1cccc(c1)[N+](=O)[O-])C)OC

STK075437
Synonyms: 4-[(4Z)-4-{[5-(4-carboxyphenyl)furan-2-yl]methylidene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)c1ccc(o1)/C=C\1/C(=NN(C1=O)c1ccc(cc1)C(=O)O)C

STK075443
Synonyms: N-(4-cyanophenyl)-N'-(pyridin-3-yl)butanediamide
Smiles: N#Cc1ccc(cc1)NC(=O)CCC(=O)Nc1cccnc1

STK075473
Synonyms: 1-(2,4-dimethylphenyl)-3-[(2-methylquinazolin-4-yl)sulfanyl]propan-2-one
Smiles: O=C(Cc1ccc(cc1C)C)CSc1nc(C)nc2c1cccc2

STK075516
Synonyms: 2-[(4-aminophenyl)sulfanyl]-1-(4-methoxyphenyl)ethanone
Smiles: COc1ccc(cc1)C(=O)CSc1ccc(cc1)N

STK075528
Synonyms: (4Z)-4-[2-(4-hydroxyphenyl)hydrazinylidene]-5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: Oc1ccc(cc1)N/N=C\1/C(=NN(C1=O)c1scc(n1)c1ccccc1)c1ccccc1

STK075551
Synonyms: (2E)-N-(4-chlorophenyl)-2-cyano-3-(3,5-dichloro-4-methoxyphenyl)prop-2-enamide
Smiles: COc1c(Cl)cc(cc1Cl)/C=C(/C(=O)Nc1ccc(cc1)Cl)\C#N

STK075576
Synonyms: methyl3-methyl-4-(5-{(Z)-[2-(pentafluorophenyl)hydrazinylidene]methyl}furan-2-yl)benzoate
Smiles: COC(=O)c1ccc(c(c1)C)c1ccc(o1)/C=N\Nc1c(F)c(F)c(c(c1F)F)F

STK075583
Synonyms: 1-(2-hydroxybenzyl)-N-(2-methoxyethyl)piperidine-4-carboxamide
Smiles: COCCNC(=O)C1CCN(CC1)Cc1ccccc1O

STK075585
Synonyms: (2E)-3-{3-chloro-4-[2-(3,5-dimethylphenoxy)ethoxy]phenyl}-2-cyano-N-(furan-2-ylmethyl)prop-2-enamide
Smiles: N#C/C(=C\c1ccc(c(c1)Cl)OCCOc1cc(C)cc(c1)C)/C(=O)NCc1ccco1

STK075634
Synonyms: ethyl4-(4-carbamoylpiperidin-1-yl)-3-oxobutanoate
Smiles: CCOC(=O)CC(=O)CN1CCC(CC1)C(=O)N

STK075641
Synonyms: (2Z)-N-hydroxy-3-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-6-nitro-2H-chromen-2-imine
Smiles: O/N=c/1\oc2ccc(cc2cc1c1scc(n1)c1ccc(cc1)C)[N+](=O)[O-]

STK075646
Synonyms: 1-(1,3-thiazol-2-yl)pyrrolidine-2,5-dione
Smiles: O=C1CCC(=O)N1c1nccs1

STK075667
Synonyms: 3-[(3-fluorophenyl)amino]-1-(furan-2-yl)propan-1-one
Smiles: Fc1cccc(c1)NCCC(=O)c1ccco1

STK075687
Synonyms: 2,2'-[3-(4-methoxyphenyl)propane-1,2-diyl]bis(1H-benzimidazole)
Smiles: COc1ccc(cc1)CC(c1nc2c([nH]1)cccc2)Cc1nc2c([nH]1)cccc2

STK075694
Synonyms: (2E)-1,3-di(1H-indol-3-yl)prop-2-en-1-one
Smiles: O=C(c1c[nH]c2c1cccc2)/C=C/c1c[nH]c2c1cccc2

STK075700
Synonyms: 1-(4-fluorophenyl)-3-(5-pentyl-1,3,4-thiadiazol-2-yl)urea
Smiles: CCCCCc1nnc(s1)NC(=O)Nc1ccc(cc1)F

STK075715
Synonyms: {4-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]-1,1-dioxido-3-(phenylcarbonyl)-2H-1,2-benzothiazin-2-yl}acetonitrile
Smiles: N#CCN1C(=C(Nc2c(=O)n(n(c2C)C)c2ccccc2)c2c(S1(=O)=O)cccc2)C(=O)c1ccccc1

STK075769
Synonyms: N-[2-chloro-4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl]-4-ethoxybenzamide
Smiles: CCOc1ccc(cc1)C(=O)Nc1ccc(cc1Cl)N1C(=O)c2c(C1=O)cccc2

STK075771
Synonyms: N-tritylvaline
Smiles: CC(C(C(=O)O)NC(c1ccccc1)(c1ccccc1)c1ccccc1)C

STK075776
Synonyms: 2-({[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino}methylidene)-5-(thiophen-2-yl)cyclohexane-1,3-dione
Smiles: Cc1ccc2c(c1)sc(n2)c1ccc(cc1)N/C=C/1\C(=O)CC(CC1=O)c1cccs1

STK075799
Synonyms: N-acetyl-N-(1-benzyl-4-phenyl-1H-imidazol-2-yl)acetamide
Smiles: CC(=O)N(c1nc(cn1Cc1ccccc1)c1ccccc1)C(=O)C

STK075848
Synonyms: 2-chloro-5-({[(4-fluorophenyl)carbonyl]carbamothioyl}amino)benzoicacid
Smiles: S=C(NC(=O)c1ccc(cc1)F)Nc1ccc(c(c1)C(=O)O)Cl

STK075850
Synonyms: 1-[3-(4-methyl-3-nitrophenyl)-4-oxa-1,2-diazaspiro[4.4]non-2-en-1-yl]ethanone
Smiles: CC(=O)N1N=C(OC21CCCC2)c1ccc(c(c1)[N+](=O)[O-])C

STK075856
Synonyms: (5Z)-5-(5-bromo-2-methoxybenzylidene)-2-(3-methylpiperidin-1-yl)-1,3-thiazol-4(5H)-one
Smiles: COc1ccc(cc1/C=C/1\SC(=NC1=O)N1CCCC(C1)C)Br

STK075863
Synonyms: N,N'-[(5,5-dioxidodibenzo[b,d]thiene-3,7-diyl)dicarbamothioyl]difuran-2-carboxamide
Smiles: S=C(NC(=O)c1ccco1)Nc1ccc2c(c1)S(=O)(=O)c1c2ccc(c1)NC(=S)NC(=O)c1ccco1

STK075879
Synonyms: [(2,4,6-trimethylphenyl)methylidyne]azaneoxide
Smiles: [O-][N+]#Cc1c(C)cc(cc1C)C

STK075961
Synonyms: 5-amino-2-(2-chlorophenyl)-3-oxo-2,3-dihydro-1,2,4-triazine-6-carbonitrile
Smiles: N#Cc1nn(c(=O)nc1N)c1ccccc1Cl

STK075975
Synonyms: 2-amino-7-methyl-4-(3-nitrophenyl)-5-oxo-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccc(c1)[N+](=O)[O-])c(=O)[nH]c(c2)C

STK075984
Synonyms: N-{[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]carbonothioyl}-4-ethoxybenzamide
Smiles: CCOc1ccc(cc1)C(=O)NC(=S)N1CCN(CC1)c1ccc(cc1Cl)[N+](=O)[O-]

STK076022
Synonyms: 4-[(1-cyclohexyl-1H-tetrazol-5-yl)methyl]morpholine
Smiles: C1CCC(CC1)n1nnnc1CN1CCOCC1

STK076048
Synonyms: 2-[(3-ethyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]propanoicacid
Smiles: CCn1c(SC(C(=O)O)C)nc2c(c1=O)c1CCCCc1s2

STK076075
Synonyms: (6Z)-6-{3-chloro-4-[3-(4-chlorophenoxy)propoxy]-5-ethoxybenzylidene}-5-imino-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Smiles: CCOc1cc(cc(c1OCCCOc1ccc(cc1)Cl)Cl)/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1

STK076084
Synonyms: methyl4-methyl-2-({[5-(2-nitrophenyl)furan-2-yl]carbonyl}amino)-1,3-thiazole-5-carboxylate
Smiles: COC(=O)c1sc(nc1C)NC(=O)c1ccc(o1)c1ccccc1[N+](=O)[O-]

STK076096
Synonyms: 2-(1,3-diphenylimidazolidin-2-yl)-1,2-dihydropyridine
Smiles: C1=CNC(C=C1)C1N(CCN1c1ccccc1)c1ccccc1

STK076109
Synonyms: (5Z,5'Z)-3,3'-ethane-1,2-diylbis[5-(4-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one]
Smiles: COc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCN1C(=S)S/C(=C\c2ccc(cc2)OC)/C1=O

STK076131
Synonyms: 2-(3,4-diethoxyphenyl)-N-(4-{[(5-methyl-1,2-oxazol-3-yl)methyl]sulfonyl}phenyl)acetamide
Smiles: CCOc1cc(ccc1OCC)CC(=O)Nc1ccc(cc1)S(=O)(=O)Cc1noc(c1)C

STK076140
Synonyms: N'-[(E)-(5-bromo-2-hydroxy-3-methoxyphenyl)methylidene]-2-(naphthalen-1-ylamino)acetohydrazide(non-preferredname)
Smiles: COc1cc(Br)cc(c1O)/C=N/NC(=O)CNc1cccc2c1cccc2

STK076147
Synonyms: N~6~-(phenylcarbamothioyl)-N~2~-[(phenylcarbamothioyl)carbamothioyl]lysine
Smiles: S=C(Nc1ccccc1)NCCCCC(C(=O)O)NC(=S)NC(=S)Nc1ccccc1

STK076158
Synonyms: 4-[(E)-(2-chlorophenyl)diazenyl]benzaldehyde
Smiles: O=Cc1ccc(cc1)/N=N/c1ccccc1Cl

STK076174
Synonyms: (2E)-N-benzyl-2-({1-[2-(3,4-dimethylphenoxy)ethyl]-1H-indol-3-yl}methylidene)hydrazinecarbothioamide
Smiles: S=C(NCc1ccccc1)N/N=C/c1cn(c2c1cccc2)CCOc1ccc(c(c1)C)C

STK076202
Synonyms: 1-(4-iodophenyl)pentan-1-one
Smiles: CCCCC(=O)c1ccc(cc1)I

STK076203
Synonyms: 2-(2-bromo-4-nitrophenoxy)-N'-[(E)-(4-hydroxy-3-methoxy-2-nitrophenyl)methylidene]acetohydrazide
Smiles: COc1c(O)ccc(c1[N+](=O)[O-])/C=N/NC(=O)COc1ccc(cc1Br)[N+](=O)[O-]

STK076212
Synonyms: N'-acetyl-5-methylfuran-3-carbohydrazide
Smiles: CC(=O)NNC(=O)c1coc(c1)C

STK076220
Synonyms: (5Z)-5-(3-chloro-5-methoxy-4-{2-[2-methoxy-4-(prop-2-en-1-yl)phenoxy]ethoxy}benzylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: C=CCc1ccc(c(c1)OC)OCCOc1c(Cl)cc(cc1OC)/C=C/1\SC(=S)NC1=O

STK076221
Synonyms: 6-chloro-3,4-dicyano-2-imino-9-methyl-N-[4-(propan-2-yl)phenyl]-2,9-dihydro-1H-pyrido[2,3-b]indole-1-carboxamide
Smiles: N#Cc1c(=N)n(C(=O)Nc2ccc(cc2)C(C)C)c2c(c1C#N)c1cc(Cl)ccc1n2C

STK076247
Synonyms: 2-fluoro-N-(pyridin-2-yl)benzamide
Smiles: O=C(c1ccccc1F)Nc1ccccn1

STK076249
Synonyms: 3-(4-nitrophenyl)-5-(4-propylcyclohexyl)-1,2,4-oxadiazole
Smiles: CCCC1CCC(CC1)c1onc(n1)c1ccc(cc1)[N+](=O)[O-]

STK076256
Synonyms: 2-phenylquinoline-4-carboxylicacid
Smiles: OC(=O)c1cc(nc2c1cccc2)c1ccccc1

STK076294
Synonyms: (6Z)-2-(2-chlorophenyl)-6-(4-fluorobenzylidene)-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Fc1ccc(cc1)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)c1ccccc1Cl

STK076304
Synonyms: (6Z)-5-imino-6-{3-methoxy-4-[2-(4-nitrophenoxy)ethoxy]benzylidene}-3-phenyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1cc(ccc1OCCOc1ccc(cc1)[N+](=O)[O-])/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1

STK076331
Synonyms: 3-(2,3-dimethoxyphenyl)-N-(3-methylphenyl)-2-(1H-tetrazol-5-yl)propanamide
Smiles: COc1c(cccc1OC)CC(C(=O)Nc1cccc(c1)C)c1nnn[nH]1

STK076343
Synonyms: 6-{[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]amino}pyridine-3-sulfonamide
Smiles: COc1ccc(cc1OC)c1csc(n1)Nc1ccc(cn1)S(=O)(=O)N

STK076354
Synonyms: N-[(1Z,3E,5E)-1-(phenylamino)-5-(phenylimino)penta-1,3-dien-2-yl]acetamide
Smiles: CC(=O)N/C(=C\Nc1ccccc1)/C=C/C=N/c1ccccc1

STK076379
Synonyms: 1-{5-[(3,4-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-3-(3-methoxyphenyl)urea
Smiles: COc1cccc(c1)NC(=O)Nc1nnc(s1)COc1ccc(c(c1)C)C

STK076388
Synonyms: 1-(3,4-dimethoxybenzyl)-N-(3-ethoxypropyl)piperidine-4-carboxamide
Smiles: CCOCCCNC(=O)C1CCN(CC1)Cc1ccc(c(c1)OC)OC

STK076398
Synonyms: 2-chloro-N'-{[(2-methylphenoxy)acetyl]oxy}benzenecarboximidamide
Smiles: O=C(O/N=C(/c1ccccc1Cl)\N)COc1ccccc1C

STK076426
Synonyms: N-{2-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]propanoyl}glycine
Smiles: OC(=O)CNC(=O)C(Oc1ccc2c(c1)oc(=O)cc2C)C

STK076452
Synonyms: 2-(4-fluorophenyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide
Smiles: O=C(Nc1scc(n1)C)Cc1ccc(cc1)F

STK076465
Synonyms: 1,3,5-triazinane-2,4-dione
Smiles: O=C1NCNC(=O)N1

STK076477
Synonyms: 2,2'-(E)-diazene-1,2-diylbis{4-phenyl-N-[(E)-phenylmethylidene]-1H-imidazol-1-amine}
Smiles: c1ccc(cc1)c1cn(c(n1)/N=N/c1nc(cn1/N=C/c1ccccc1)c1ccccc1)/N=C/c1ccccc1

STK076524
Synonyms: 2,4-dichloro-N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide
Smiles: Clc1ccc(nc1)NC(=S)NC(=O)c1ccc(cc1Cl)Cl

STK076549
Synonyms: 7-chloro-4-[(2E)-2-(2,5-dimethoxybenzylidene)hydrazinyl]quinoline
Smiles: COc1ccc(cc1/C=N/Nc1ccnc2c1ccc(c2)Cl)OC

STK076553
Synonyms: (5Z)-2-(2,6-dimethylmorpholin-4-yl)-5-(4-nitrobenzylidene)-1,3-thiazol-4(5H)-one
Smiles: CC1OC(C)CN(C1)C1=NC(=O)/C(=C/c2ccc(cc2)[N+](=O)[O-])/S1

STK076579
Synonyms: 2-(tert-butylcarbamoyl)phenylacetate
Smiles: CC(=O)Oc1ccccc1C(=O)NC(C)(C)C

STK076597
Synonyms: 2-[2-(4-chlorophenyl)ethyl]-3-{[3-(morpholin-4-yl)propyl]amino}-2,3-dihydro-1H-isoindol-1-one
Smiles: Clc1ccc(cc1)CCN1C(=O)c2c(C1NCCCN1CCOCC1)cccc2

STK076603
Synonyms: N-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine
Smiles: CNc1nc(OCC(F)(F)F)nc(n1)N

STK076609
Synonyms: 3,4,5-trimethoxy-N-{2-methyl-1-[(3,4,5-trimethoxyphenyl)carbonyl]-1,2,3,4-tetrahydroquinolin-4-yl}-N-phenylbenzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)N(C1CC(C)N(c2c1cccc2)C(=O)c1cc(OC)c(c(c1)OC)OC)c1ccccc1

STK076619
Synonyms: N-[(E)-(2-chlorophenyl)methylidene]-2-nitroaniline
Smiles: Clc1ccccc1/C=N/c1ccccc1[N+](=O)[O-]

STK076644
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-nitrophenyl)-3-oxo-2-(2-oxopyridin-1(2H)-yl)propanamide
Smiles: COc1cc(CCNC(=O)C(n2ccccc2=O)C(=O)c2cccc(c2)[N+](=O)[O-])ccc1OC

STK076646
Synonyms: 2-[(1-butyl-1H-benzimidazol-2-yl)sulfanyl]-1-(naphthalen-1-yl)ethanone
Smiles: CCCCn1c(SCC(=O)c2cccc3c2cccc3)nc2c1cccc2

STK076687
Synonyms: N'-[(E)-(2,4-dihydroxyphenyl)methylidene]-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetohydrazide
Smiles: Oc1ccc(c(c1)O)/C=N/NC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C

STK076691
Synonyms: 3-(5,6-dimethyl-1H-benzimidazol-2-yl)-4-hydroxyquinolin-2(1H)-one
Smiles: Cc1cc2[nH]c(nc2cc1C)c1c(=O)[nH]c2c(c1O)cccc2

STK076709
Synonyms: N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-oxo-4-{2-[(2,5,7-trimethyl-1H-indol-3-yl)acetyl]hydrazinyl}butanamide
Smiles: O=C(NNC(=O)Cc1c(C)[nH]c2c1cc(C)cc2C)CCC(=O)Nc1c(=O)n(n(c1C)C)c1ccccc1

STK076767
Synonyms: 2-{[(3,5-dibromopyridin-2-yl)amino]methyl}-5-methoxyphenol
Smiles: COc1ccc(c(c1)O)CNc1ncc(cc1Br)Br

STK076796
Synonyms: N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-N'-(prop-2-en-1-yl)butanediamide
Smiles: C=CCNC(=O)CCC(=O)Nc1c(C)n(n(c1=O)c1ccccc1)C

STK076800
Synonyms: 3-methoxy-2-[2-(pyrrolidin-1-yl)ethyl]-2,3-dihydro-1H-isoindol-1-one
Smiles: COC1N(CCN2CCCC2)C(=O)c2c1cccc2

STK076823
Synonyms: isoquinoline-5-carbonitrile
Smiles: N#Cc1cccc2c1ccnc2

STK076831
Synonyms: 3-(4-methylphenyl)-2-phenyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: Cc1ccc(cc1)n1c(nc2c(c1=O)c1CCCc1s2)c1ccccc1

STK076839
Synonyms: 3-hydroxy-N-methylnaphthalene-2-carboxamide-4-chloro-2-(iminomethyl)phenol(1:1)
Smiles: CNC(=O)c1cc2ccccc2cc1O.N=Cc1cc(Cl)ccc1O

STK076862
Synonyms: [5-hydroxy-5-(pentafluoroethyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl](4-methylphenyl)methanone
Smiles: Cc1ccc(cc1)C(=O)N1N=C(CC1(O)C(C(F)(F)F)(F)F)c1ccccc1

STK076866
Synonyms: N-(4-bromophenyl)-2-[(3,5-dicyano-4-methyl-6-oxo-1,4,5,6-tetrahydropyridin-2-yl)sulfanyl]acetamide
Smiles: CC1C(=C(SCC(=O)Nc2ccc(cc2)Br)NC(=O)C1C#N)C#N

STK076889
Synonyms: N'-{(E)-phenyl[4-(trifluoromethyl)phenyl]methylidene}pyridine-2-carbohydrazide
Smiles: O=C(c1ccccn1)N/N=C(/c1ccc(cc1)C(F)(F)F)\c1ccccc1

STK076918
Synonyms: ethyl(2E)-3-{1-[2-(2-chlorophenoxy)ethyl]-2-methyl-1H-indol-3-yl}-2-cyanoprop-2-enoate
Smiles: CCOC(=O)/C(=C/c1c(C)n(c2c1cccc2)CCOc1ccccc1Cl)/C#N

STK076922
Synonyms: 2-(2-chlorophenyl)-1-hydroxy-1,5,6,7-tetrahydro-4H-benzimidazol-4-one
Smiles: Clc1ccccc1c1nc2c(n1O)CCCC2=O

STK076923
Synonyms: 2-(benzylimino)-5,5-diethyldihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCC1(CC)C(=O)NC(=NCc2ccccc2)NC1=O

STK076940
Synonyms: (5Z)-3-(4-bromobenzyl)-5-(2-hydroxy-3-methoxy-5-nitrobenzylidene)imidazolidine-2,4-dione
Smiles: COc1cc(cc(c1O)/C=C/1\NC(=O)N(C1=O)Cc1ccc(cc1)Br)[N+](=O)[O-]

STK076958
Synonyms: N-(2-hydroxy-4,5-dimethylphenyl)-4-methyl-3-nitrobenzamide
Smiles: O=C(c1ccc(c(c1)[N+](=O)[O-])C)Nc1cc(C)c(cc1O)C

STK076965
Synonyms: methyl5-phenyl-1,2,4-oxadiazole-3-carboxylate
Smiles: COC(=O)c1noc(n1)c1ccccc1

STK076967
Synonyms: [5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl](cyclopropyl)methanone
Smiles: O=C(N1N=C(CC1(O)C(C)(C)C)C(F)(F)F)C1CC1

STK076989
Synonyms: N-(5-chloro-2-methylphenyl)-2-(4-methylphenoxy)acetamide
Smiles: O=C(Nc1cc(Cl)ccc1C)COc1ccc(cc1)C

STK076999
Synonyms: N-(4-cyanophenyl)-N'-(3-methylbutyl)butanediamide
Smiles: CC(CCNC(=O)CCC(=O)Nc1ccc(cc1)C#N)C

STK077012
Synonyms: 3-(biphenyl-4-yl)-N'-[(1E)-1-(4-methylphenyl)ethylidene]-1H-pyrazole-5-carbohydrazide
Smiles: Cc1ccc(cc1)/C(=N/NC(=O)c1[nH]nc(c1)c1ccc(cc1)c1ccccc1)/C

STK077020
Synonyms: [1-(morpholin-4-ylmethyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]propanedinitrile
Smiles: N#CC(=C1C(=O)N(c2c1cccc2)CN1CCOCC1)C#N

STK077030
Synonyms: 2-[3-chloro-5-ethoxy-4-(naphthalen-1-ylmethoxy)phenyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCOc1cc(cc(c1OCc1cccc2c1cccc2)Cl)c1nc2sc3c(c2c(=O)[nH]1)CCCC3

STK077032
Synonyms: ethyl(2Z)-2-{[1-(cyanomethyl)-2-methyl-1H-indol-3-yl]methylidene}-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)SC)c(=O)/c(=C/c1c(C)n(c3c1cccc3)CC#N)/s2

STK077046
Synonyms: 2-(4-chlorophenoxy)-N'-[(1E)-1-(2-hydroxyphenyl)ethylidene]acetohydrazide
Smiles: O=C(COc1ccc(cc1)Cl)N/N=C(/c1ccccc1O)\C

STK077078
Synonyms: N-[4-(phenylamino)phenyl]tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Smiles: O=C(C12CC3CC(C2)CC(C1)C3)Nc1ccc(cc1)Nc1ccccc1

STK077082
Synonyms: 2,5-dioxopyrrolidin-1-ylO-benzyl-N-[(9H-fluoren-9-ylmethoxy)carbonyl]threoninate
Smiles: O=C(NC(C(=O)ON1C(=O)CCC1=O)C(OCc1ccccc1)C)OCC1c2ccccc2c2c1cccc2

STK077085
Synonyms: N-(1-hydroxy-2-methylpropan-2-yl)-1-(3-methoxybenzyl)piperidine-4-carboxamide
Smiles: OCC(NC(=O)C1CCN(CC1)Cc1cccc(c1)OC)(C)C

STK077126
Synonyms: (4E)-5-methyl-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-4-[2-(2,4,6-trimethylphenyl)hydrazinylidene]-2,4-dihydro-3H-pyrazol-3-one
Smiles: Cc1ccc(cc1)c1csc(n1)N1N=C(/C(=N\Nc2c(C)cc(cc2C)C)/C1=O)C

STK077181
Synonyms: 4-{[(E)-(4-methoxynaphthalen-1-yl)methylidene]amino}benzamide
Smiles: COc1ccc(c2c1cccc2)/C=N/c1ccc(cc1)C(=O)N

STK077190
Synonyms: 4-methoxy-6-methyl-2-(methylsulfonyl)pyrimidine
Smiles: COc1cc(C)nc(n1)S(=O)(=O)C

STK077193
Synonyms: 2-oxo-2-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]ethyl(2E)-3-(furan-2-yl)prop-2-enoate
Smiles: CCCc1nnc(s1)NC(=O)COC(=O)/C=C/c1ccco1

STK077208
Synonyms: N-[3-cyano-5-ethyl-4-(furan-2-yl)-6-propylpyridin-2-yl]acetamide
Smiles: CCCc1nc(NC(=O)C)c(c(c1CC)c1ccco1)C#N

STK077221
Synonyms: 2,5-dimethyl-1H-benzimidazole
Smiles: Cc1ccc2c(c1)nc([nH]2)C

STK077234
Synonyms: (3-fluorophenyl)[4-(1H-indol-3-ylmethyl)piperazin-1-yl]methanone
Smiles: Fc1cccc(c1)C(=O)N1CCN(CC1)Cc1c[nH]c2c1cccc2

STK077288
Synonyms: tetramethyl9'-ethoxy-5',5'-dimethyl-6'-{[(4-methylphenyl)sulfonyl]carbamoyl}-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Smiles: CCOc1ccc2c(c1)C1=C(C(N2C(=O)NS(=O)(=O)c2ccc(cc2)C)(C)C)SC(=C(C21SC(=C(S2)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC

STK077289
Synonyms: 1-(4-chlorophenyl)-3-[(pyridin-3-ylmethyl)amino]pyrrolidine-2,5-dione
Smiles: Clc1ccc(cc1)N1C(=O)CC(C1=O)NCc1cccnc1

STK077291
Synonyms: 2-[2-(6-chloro-2-imino-2H-chromen-3-yl)-1,3-thiazol-4-yl]-3H-benzo[f]chromen-3-one
Smiles: Clc1ccc2c(c1)cc(c(=N)o2)c1scc(n1)c1cc2c(oc1=O)ccc1c2cccc1

STK077300
Synonyms: N-(4-fluorobenzyl)-N-methylbutan-1-amine
Smiles: CCCCN(Cc1ccc(cc1)F)C

STK077330
Synonyms: 6,8-dichloro-3-[2-(6-nitro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-4-yl]-2H-chromen-2-one
Smiles: Clc1cc(Cl)c2c(c1)cc(c(=O)o2)c1csc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK077407
Synonyms: 4-(2-chloro-4-{[(5-chloro-2-hydroxyphenyl)carbonyl]amino}phenyl)-N,N-diethylpiperazine-1-carboxamide
Smiles: CCN(C(=O)N1CCN(CC1)c1ccc(cc1Cl)NC(=O)c1cc(Cl)ccc1O)CC

STK077411
Synonyms: 4-nitroanilinium4-(2-oxopyrrolidin-1-yl)benzenesulfonate
Smiles: [O-][N+](=O)c1ccc(cc1)[NH3+].O=C1CCCN1c1ccc(cc1)S(=O)(=O)[O-]

STK077444
Synonyms: 5-acetyl-2-amino-N-(4-fluorophenyl)-4-methylthiophene-3-carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1c(N)sc(c1C)C(=O)C

STK077450
Synonyms: (4E)-2-(1,3-benzothiazol-2-yl)-4-{[(3-hydroxypropyl)amino]methylidene}-5-{[(4-methylphenyl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one
Smiles: OCCCN/C=C/1\C(=NN(C1=O)c1nc2c(s1)cccc2)CSc1ccc(cc1)C

STK077464
Synonyms: 2-(biphenyl-4-yl)-5-(4-butoxyphenyl)-1,3,4-thiadiazole
Smiles: CCCCOc1ccc(cc1)c1nnc(s1)c1ccc(cc1)c1ccccc1

STK077481
Synonyms: (2-methylphenyl)(phenyl)bromonium
Smiles: Cc1ccccc1[Br+]c1ccccc1

STK077483
Synonyms: 2-(5-chloro-2-oxopyridin-1(2H)-yl)-1-[4-(3,4-dihydroisoquinolin-2(1H)-ylcarbonyl)piperidin-1-yl]-3-phenylpropane-1,3-dione
Smiles: Clc1ccc(=O)n(c1)C(C(=O)c1ccccc1)C(=O)N1CCC(CC1)C(=O)N1CCc2c(C1)cccc2

STK077546
Synonyms: N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]-4-(propan-2-yloxy)benzamide
Smiles: CC(Oc1ccc(cc1)C(=O)NC(=S)Nc1scc(n1)c1ccccc1)C

STK077572
Synonyms: (2E)-4-{[2-(3,4-dimethoxyphenyl)ethyl][1-(4-fluorophenyl)-2,5-dioxopyrrolidin-3-yl]amino}-4-oxobut-2-enoicacid
Smiles: COc1cc(CCN(C2CC(=O)N(C2=O)c2ccc(cc2)F)C(=O)/C=C/C(=O)O)ccc1OC

STK077612
Synonyms: 3-phenyl-9-(trifluoromethyl)-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazoline
Smiles: FC(c1c2CCCCc2nc2n1ncc2c1ccccc1)(F)F

STK077623
Synonyms: 7-(2,4-dichlorobenzyl)-8-hydroxy-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(c(c1)Cl)Cn1c(O)nc2c1c(=O)n(C)c(=O)n2C

STK077632
Synonyms: N-(1,3-benzothiazol-2-yl)-2,2-dichloroacetamide
Smiles: O=C(C(Cl)Cl)Nc1nc2c(s1)cccc2

STK077649
Synonyms: N-(5-methyl-4-oxo-4,5-dihydro-1,3-thiazol-2-yl)benzamide
Smiles: CC1SC(=NC1=O)NC(=O)c1ccccc1

STK077655
Synonyms: 3-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]pyridine
Smiles: Fc1ccc(cc1)c1onc(n1)c1cccnc1

STK077675
Synonyms: 3-amino-N-(4-bromophenyl)-4-cyano-5-(phenylamino)thiophene-2-carboxamide
Smiles: N#Cc1c(Nc2ccccc2)sc(c1N)C(=O)Nc1ccc(cc1)Br

STK077677
Synonyms: 1,1'-(1,1':4',1''-terphenyl-4,4''-diyl)dihexan-1-one
Smiles: CCCCCC(=O)c1ccc(cc1)c1ccc(cc1)c1ccc(cc1)C(=O)CCCCC

STK077683
Synonyms: {[(4E)-4-[(2,6-dimethylphenyl)imino]-1-(2-hydroxyphenyl)-1,3-diazaspiro[4.4]non-2-en-2-yl]sulfanyl}aceticacid
Smiles: OC(=O)CSC1=N/C(=N/c2c(C)cccc2C)/C2(N1c1ccccc1O)CCCC2

STK077693
Synonyms: (3Z)-5-bromo-3-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]-1,3-dihydro-2H-indol-2-one
Smiles: Brc1ccc2c(c1)/C(=C\1/SC(=S)N(C1=O)CC1CCCO1)/C(=O)N2

STK077705
Synonyms: 4-(5-methyl-1H-pyrrol-2-yl)-4-oxobutanoicacid
Smiles: Cc1ccc([nH]1)C(=O)CCC(=O)O

STK077717
Synonyms: (4Z)-5-oxo-3-phenyl-4-(2-phenylhydrazinylidene)-4,5-dihydro-1H-pyrazole-1-carbothioamide
Smiles: NC(=S)N1N=C(/C(=N/Nc2ccccc2)/C1=O)c1ccccc1

STK077740
Synonyms: 1-ethyl-6-fluoro-7-{4-[(2-nitrophenyl)carbonyl]piperazin-1-yl}-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccccc1[N+](=O)[O-])c(c2)F

STK077763
Synonyms: N,4-dimethylbenzamide-2,4-dibromo-6-(iminomethyl)phenol(1:1)
Smiles: CNC(=O)c1ccc(cc1)C.N=Cc1cc(Br)cc(c1O)Br

STK077770
Synonyms: 2-{[3-(dimethylamino)propyl]sulfanyl}-3-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)n1c(SCCCN(C)C)nc2c(c1=O)cccc2

STK077798
Synonyms: 4-[(E)-(2-methoxyphenyl)diazenyl]-1,2-oxazole-3,5-diamine
Smiles: COc1ccccc1/N=N/c1c(N)noc1N

STK077811
Synonyms: 1-(2,5-dimethoxybenzyl)-N-(tetrahydrofuran-2-ylmethyl)piperidine-4-carboxamide
Smiles: COc1ccc(cc1CN1CCC(CC1)C(=O)NCC1CCCO1)OC

STK077819
Synonyms: N'-[(E)-{4-[3-(2-chlorophenoxy)propoxy]-3-methoxyphenyl}methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)C)ccc1OCCCOc1ccccc1Cl

STK077845
Synonyms: bis(pentafluorophenyl)carbonate
Smiles: O=C(Oc1c(F)c(F)c(c(c1F)F)F)Oc1c(F)c(F)c(c(c1F)F)F

STK077858
Synonyms: 2-[(4-hydroxy-6-methylpyrimidin-2-yl)amino]-7-methylquinazolin-4-ol
Smiles: Cc1nc(nc(c1)O)Nc1nc(O)c2c(n1)cc(cc2)C

STK077865
Synonyms: 5-(2,4-dichlorophenoxy)-3-nitro-1-(prop-2-en-1-yl)-1H-1,2,4-triazole
Smiles: C=CCn1nc(nc1Oc1ccc(cc1Cl)Cl)[N+](=O)[O-]

STK077871
Synonyms: N'-[(E)-(4-hydroxy-3-iodophenyl)methylidene]-2-(naphthalen-1-ylamino)acetohydrazide(non-preferredname)
Smiles: O=C(CNc1cccc2c1cccc2)N/N=C/c1ccc(c(c1)I)O