COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION
FULL DB
Total number of items: 1633432
Total number of pages: 1634 ( 1000 items on each page )
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STK967229
Synonyms: 1-(2-cyanophenyl)-3-[2-(piperidin-1-yl)-5-(pyrrolidin-1-ylsulfonyl)phenyl]urea
Smiles: N#Cc1ccccc1NC(=O)Nc1cc(ccc1N1CCCCC1)S(=O)(=O)N1CCCC1
STK967230
Synonyms: 2-chloro-N-[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]benzamide
Smiles: O=C(c1ccccc1Cl)Nc1cn(nc1c1cccs1)c1ccccc1
STK967231
Synonyms: {[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]sulfinyl}aceticacid
Smiles: O=S(Cc1cn(nc1c1ccccc1)c1ccccc1)CC(=O)O
STK967232
Synonyms: 4-(4-hydroxyphenyl)-N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)piperazine-1-carboxamide
Smiles: CC1CCc2c(C1)sc(n2)NC(=O)N1CCN(CC1)c1ccc(cc1)O
STK967233
Synonyms: 1-[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]-N-methylmethanamine
Smiles: CNCc1cn(nc1c1ccc(cc1)F)c1ccccc1
STK967234
Synonyms: 1-[4-(diethylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]-5-imino-2-methyl-4-phenylpyrrolidin-3-one
Smiles: CCN(c1nc(nc(n1)N1C(C)C(=O)C(C1=N)c1ccccc1)N(C)C)CC
STK967235
Synonyms: 3-(4-chloro-2-nitrophenyl)-2-[(5-methyl-2-oxo-2,3-dihydro-1H-indol-3-yl)methyl]quinazolin-4(3H)-one
Smiles: Clc1ccc(c(c1)[N+](=O)[O-])n1c(CC2C(=O)Nc3c2cc(C)cc3)nc2c(c1=O)cccc2
STK967236
Synonyms: 3-benzyl-2-[(5-bromo-1-ethyl-2-oxo-2,3-dihydro-1H-indol-3-yl)methyl]quinazolin-4(3H)-one
Smiles: CCN1C(=O)C(c2c1ccc(c2)Br)Cc1nc2ccccc2c(=O)n1Cc1ccccc1
STK967237
Synonyms: 5-[4-(benzyloxy)phenyl]-2-(hydroxymethyl)-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: OCn1nc(n(c1=S)c1ccccc1)c1ccc(cc1)OCc1ccccc1
STK967238
Synonyms: 5-(1-benzofuran-2-yl)-2-(hydroxymethyl)-4-(prop-2-en-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: C=CCn1c(nn(c1=S)CO)c1cc2c(o1)cccc2
STK967247
Synonyms: 4-amino-3-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}-6-methyl-1,2,4-triazin-5(4H)-one
Smiles: Clc1ccc2c(c1)c(CCNc1nnc(c(=O)n1N)C)c[nH]2
STK967252
Synonyms: 1-(4-methylphenyl)-2-[phenyl(3,4,5,6-tetrahydro-2H-azepin-7-yl)amino]ethanone
Smiles: Cc1ccc(cc1)C(=O)CN(C1=NCCCCC1)c1ccccc1
STK967255
Synonyms: 2-(3-ethoxy-4-hydroxyphenyl)-7,8,9,10-tetrahydropyrimido[1,2-a]azepin-4(6H)-one
Smiles: CCOc1cc(ccc1O)c1nc2CCCCCn2c(=O)c1
STK967256
Synonyms: 2-[(3-methylphenyl)(3,4,5,6-tetrahydro-2H-azepin-7-yl)amino]-1-phenylethanone
Smiles: Cc1cccc(c1)N(C1=NCCCCC1)CC(=O)c1ccccc1
STK967258
Synonyms: (2Z)-3-methyl-4-({3-methyl-4-[(E)-(2-methylphenyl)diazenyl]phenyl}amino)-4-oxobut-2-enoicacid
Smiles: OC(=O)/C=C(\C(=O)Nc1ccc(c(c1)C)/N=N/c1ccccc1C)/C
STK967259
Synonyms: 1-(4-fluorophenyl)-1-oxopropan-2-yl4-hydroxy-3,5-dimethoxybenzoate
Smiles: COc1cc(cc(c1O)OC)C(=O)OC(C(=O)c1ccc(cc1)F)C
STK967262
Synonyms: 5-bromo-2-methoxy-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)Nn1cnnc1)Br
STK967263
Synonyms: N-(3,5-dimethylphenyl)-2-oxo-3,4-dihydro-2H-chromene-6-sulfonamide
Smiles: O=C1CCc2c(O1)ccc(c2)S(=O)(=O)Nc1cc(C)cc(c1)C
STK967264
Synonyms: 1-[(4-ethoxy-3-ethylphenyl)sulfonyl]-1H-benzotriazole
Smiles: CCOc1ccc(cc1CC)S(=O)(=O)n1nnc2c1cccc2
STK967265
Synonyms: 2,4-dichloro-N-ethylbenzenesulfonamide
Smiles: CCNS(=O)(=O)c1ccc(cc1Cl)Cl
STK967266
Synonyms: 4-methoxy-2,3-dimethyl-N-propylbenzenesulfonamide
Smiles: CCCNS(=O)(=O)c1ccc(c(c1C)C)OC
STK967267
Synonyms: N-(butan-2-yl)-5-ethyl-2-methoxybenzenesulfonamide
Smiles: CCC(NS(=O)(=O)c1cc(CC)ccc1OC)C
STK967268
Synonyms: 2,5-diethoxy-N-(3-methoxypropyl)-4-methylbenzenesulfonamide
Smiles: COCCCNS(=O)(=O)c1cc(OCC)c(cc1OCC)C
STK967269
Synonyms: 1-[(1-chloronaphthalen-2-yl)oxy]-3-(1H-1,2,4-triazol-1-yl)propan-2-ol
Smiles: OC(Cn1cncn1)COc1ccc2c(c1Cl)cccc2
STK967270
Synonyms: N-(2-methoxyphenyl)-2-[6-methyl-5-(4-methylphenyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetamide
Smiles: COc1ccccc1NC(=O)Cn1cnc2c(c1=O)c(c1ccc(cc1)C)c(s2)C
STK967271
Synonyms: 3-(4-methylphenyl)-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-4-one
Smiles: Cc1ccc(cc1)c1csc2c1c(=O)n1c(n2)CCCC1
STK967272
Synonyms: 2-({1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-1H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: NC(=O)CSc1ncn(n1)c1nc(nc(n1)N(C)C)N(C)C
STK967273
Synonyms: [4-(2,4-dichlorophenoxy)-6-methylpyrimidin-2-yl]methylcyanamide
Smiles: N#CN(c1nc(cc(n1)C)Oc1ccc(cc1Cl)Cl)C
STK967274
Synonyms: 6-({4-[(6-ethoxypyridazin-3-yl)sulfanyl]-6-methylpyrimidin-2-yl}oxy)pyridazin-3-ol
Smiles: CCOc1ccc(nn1)Sc1cc(C)nc(n1)Oc1ccc(nn1)O
STK967275
Synonyms: 6-({4-[(6-ethoxypyridazin-3-yl)sulfanyl]-6-methylpyrimidin-2-yl}oxy)-2-methylpyridazin-3(2H)-one
Smiles: CCOc1ccc(nn1)Sc1cc(C)nc(n1)Oc1ccc(=O)n(n1)C
STK967276
Synonyms: 6-({4-(dimethylamino)-6-[(6-methoxypyridazin-3-yl)sulfanyl]pyrimidin-2-yl}oxy)-2-phenylpyridazin-3(2H)-one
Smiles: COc1ccc(nn1)Sc1cc(nc(n1)Oc1ccc(=O)n(n1)c1ccccc1)N(C)C
STK967277
Synonyms: 6-({4-(dimethylamino)-6-[(6-ethoxypyridazin-3-yl)sulfanyl]-1,3,5-triazin-2-yl}oxy)pyridazin-3-ol
Smiles: CCOc1ccc(nn1)Sc1nc(Oc2ccc(nn2)O)nc(n1)N(C)C
STK967278
Synonyms: 4-[(6-ethoxypyridazin-3-yl)sulfanyl]-6-methylpyrimidine-2-thiol
Smiles: CCOc1ccc(nn1)Sc1cc(C)nc(n1)S
STK967279
Synonyms: 5-heptyl-2-[(2-methoxyphenyl)amino]-6-methylpyrimidin-4-ol
Smiles: CCCCCCCc1c(C)nc(nc1O)Nc1ccccc1OC
STK967280
Synonyms: (2E)-4-oxo-4-(2-{3-[4-(propan-2-yloxy)phenyl]propanoyl}hydrazinyl)but-2-enoicacid
Smiles: CC(Oc1ccc(cc1)CCC(=O)NNC(=O)/C=C/C(=O)O)C
STK967281
Synonyms: 2-{[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}hexanoicacid
Smiles: CCCCC(C(=O)O)Sc1nnc(n1c1ccccc1)c1ccc(cc1)OC
STK967282
Synonyms: N,N'-dibenzylpyrimidine-4,6-diamine
Smiles: c1ccc(cc1)CNc1ncnc(c1)NCc1ccccc1
STK967283
Synonyms: 2-(benzylamino)-5-[4-(2-methylpropoxy)benzyl]pyrimidine-4,6-diol
Smiles: CC(COc1ccc(cc1)Cc1c(O)nc(nc1O)NCc1ccccc1)C
STK967284
Synonyms: 2-[(2-hydroxyethyl)amino]-6-methyl-5-octylpyrimidin-4-ol
Smiles: CCCCCCCCc1c(C)nc(nc1O)NCCO
STK967285
Synonyms: 2-{[2-(2-methylpropoxy)benzyl]oxy}-N-phenylhydrazinecarbothioamide
Smiles: CC(COc1ccccc1CONNC(=S)Nc1ccccc1)C
STK967286
Synonyms: 2-(hydroxymethyl)-5-(4-hydroxyphenyl)-4-(prop-2-en-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: C=CCn1c(nn(c1=S)CO)c1ccc(cc1)O
STK967287
Synonyms: 2-[(5-heptyl-4-hydroxy-6-methylpyrimidin-2-yl)sulfanyl]hexanoicacid
Smiles: CCCCCCCc1c(C)nc(nc1O)SC(C(=O)O)CCCC
STK967288
Synonyms: 5-(2-ethoxyphenyl)-2-(hydroxymethyl)-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccccc1c1nn(c(=S)n1c1ccccc1)CO
STK967289
Synonyms: N-[2-(4-butoxyphenyl)propyl]-1,3,5-triazine-2,4-diamine
Smiles: CCCCOc1ccc(cc1)C(CNc1ncnc(n1)N)C
STK967290
Synonyms: N-[2-(4-ethoxyphenyl)-2-methylpropyl]-1,3,5-triazine-2,4-diamine
Smiles: CCOc1ccc(cc1)C(CNc1ncnc(n1)N)(C)C
STK967294
Synonyms: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1,2,3-thiadiazole-4-carboxamide
Smiles: Cc1ccc2c(c1)sc(n2)c1ccc(cc1)NC(=O)c1csnn1
STK967297
Synonyms: N-{[(5E)-5-benzylidene-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetyl}norvaline
Smiles: CCCC(C(=O)O)NC(=O)CN1C(=S)S/C(=C/c2ccccc2)/C1=O
STK967298
Synonyms: N-{3-[(5E)-5-benzylidene-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}norvaline
Smiles: CCCC(C(=O)O)NC(=O)CCN1C(=S)S/C(=C/c2ccccc2)/C1=O
STK967302
Synonyms: 1-[bis(2-hydroxyethyl)amino]-3-(tricyclo[3.3.1.1~3,7~]dec-1-yloxy)propan-2-ol
Smiles: OCCN(CC(COC12CC3CC(C2)CC(C1)C3)O)CCO
STK967303
Synonyms: 1-(4-benzylpiperidin-1-yl)-3-(tricyclo[3.3.1.1~3,7~]dec-1-yloxy)propan-2-ol
Smiles: OC(CN1CCC(CC1)Cc1ccccc1)COC12CC3CC(C2)CC(C1)C3
STK967304
Synonyms: 1-(4-benzylpiperazin-1-yl)-3-(tricyclo[3.3.1.1~3,7~]dec-1-yloxy)propan-2-ol
Smiles: OC(CN1CCN(CC1)Cc1ccccc1)COC12CC3CC(C2)CC(C1)C3
STK967305
Synonyms: 1-[benzyl(ethyl)amino]-3-(tricyclo[3.3.1.1~3,7~]dec-1-yloxy)propan-2-ol
Smiles: CCN(Cc1ccccc1)CC(COC12CC3CC(C2)CC(C1)C3)O
STK967306
Synonyms: 1-[2-hydroxy-3-(tricyclo[3.3.1.1~3,7~]dec-1-yloxy)propyl]-2,2,6,6-tetramethylpiperidin-4-ol
Smiles: OC(CN1C(C)(C)CC(CC1(C)C)O)COC12CC3CC(C2)CC(C1)C3
STK967307
Synonyms: 1-(1H-benzimidazol-1-yl)-3-(tricyclo[3.3.1.1~3,7~]dec-1-yloxy)propan-2-ol
Smiles: OC(Cn1cnc2c1cccc2)COC12CC3CC(C2)CC(C1)C3
STK967308
Synonyms: 3-(propan-2-yl)-1H-spiro[benzo[h]quinazoline-5,1'-cyclohexane]-2,4(3H,6H)-dione
Smiles: CC(n1c(=O)[nH]c2c(c1=O)C1(CCCCC1)Cc1c2cccc1)C
STK967317
Synonyms: N-(4-chlorophenyl)-4,6-di(morpholin-4-yl)-1,3,5-triazin-2-amine
Smiles: Clc1ccc(cc1)Nc1nc(nc(n1)N1CCOCC1)N1CCOCC1
STK967327
Synonyms: N-(7-methylimidazo[1,2-a]pyridin-2-yl)benzamide
Smiles: Cc1ccn2c(c1)nc(c2)NC(=O)c1ccccc1
STK967328
Synonyms: 2-{[(4-bromophenoxy)acetyl]amino}-9-pentofuranosyl-1,9-dihydro-6H-purin-6-one
Smiles: OCC1OC(C(C1O)O)n1cnc2c1nc(NC(=O)COc1ccc(cc1)Br)[nH]c2=O
STK967330
Synonyms: 2-[(methoxyacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: COCC(=O)Nc1sc2c(c1C(=O)N)CCCC2
STK967331
Synonyms: 2-(4-bromophenyl)-2-methyl-N-(4H-1,2,4-triazol-3-yl)propanamide
Smiles: O=C(C(c1ccc(cc1)Br)(C)C)Nc1[nH]cnn1
STK967332
Synonyms: ({5-[2-(heptyloxy)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)aceticacid
Smiles: CCCCCCCOc1ccccc1c1nnc([nH]1)SCC(=O)O
STK967333
Synonyms: 6-methyl-2-[(2-methylprop-2-en-1-yl)sulfanyl]-5-(2-methylpropyl)pyrimidin-4-ol
Smiles: CC(=C)CSc1nc(C)c(c(n1)O)CC(C)C
STK967334
Synonyms: 4-[5-(butylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]phenol
Smiles: CCCCSc1nnc(n1c1ccccc1)c1ccc(cc1)O
STK967335
Synonyms: 4,6-dichloro-5-(4-ethoxybenzyl)pyrimidine
Smiles: CCOc1ccc(cc1)Cc1c(Cl)ncnc1Cl
STK967336
Synonyms: 4-benzyl-5-[(3-bromophenoxy)methyl]-4H-1,2,4-triazole-3-thiol
Smiles: Brc1cccc(c1)OCc1nnc(n1Cc1ccccc1)S
STK967337
Synonyms: 5-(4-ethoxybenzyl)-6-methyl-2-(morpholin-4-yl)pyrimidin-4-ol
Smiles: CCOc1ccc(cc1)Cc1c(C)nc(nc1O)N1CCOCC1
STK967338
Synonyms: 5-(3-methyl-4-propoxybenzyl)-2-(morpholin-4-yl)pyrimidine-4,6-diol
Smiles: CCCOc1ccc(cc1C)Cc1c(O)nc(nc1O)N1CCOCC1
STK967351
Synonyms: 2-methoxyphenyl4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylate
Smiles: COc1ccccc1OC(=O)C12CCC(C2(C)C)(C(=O)O1)C
STK967352
Synonyms: 1-(2,3-dihydro-1H-indol-1-ylcarbonyl)-4,7,7-trimethyl-2-oxabicyclo[2.2.1]heptan-3-one
Smiles: O=C(C12CCC(C2(C)C)(C(=O)O1)C)N1CCc2c1cccc2
STK967353
Synonyms: 1-(2-carboxyethyl)-3-(naphthalen-2-yl)-1H-pyrazole-4-carboxylicacid
Smiles: OC(=O)CCn1cc(c(n1)c1ccc2c(c1)cccc2)C(=O)O
STK967354
Synonyms: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-1H-pyrazole-4-carboxylicacid
Smiles: OC(=O)c1cn(nc1c1ccc2c(c1)OCCO2)c1ccccc1
STK967355
Synonyms: 1-phenyl-3-(pyridin-4-yl)-1H-pyrazole-4-carboxylicacid
Smiles: OC(=O)c1cn(nc1c1ccncc1)c1ccccc1
STK967356
Synonyms: 4-(thiophen-2-yl)-6-[4-(trifluoromethoxy)phenyl]-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: O=C1NC2=C(C(N1)c1cccs1)C(=O)N(C2)c1ccc(cc1)OC(F)(F)F
STK967359
Synonyms: 1H-benzimidazol-2-yl(5-bromo-6-oxo-1-phenyl-1,6-dihydropyridazin-4-yl)acetonitrile
Smiles: N#CC(c1cnn(c(=O)c1Br)c1ccccc1)c1nc2c([nH]1)cccc2
STK967360
Synonyms: (2E)-3-[(2-ethoxyphenyl)amino]-1-phenylprop-2-en-1-one
Smiles: CCOc1ccccc1N/C=C/C(=O)c1ccccc1
STK967361
Synonyms: 3-(2-butoxyphenyl)-6-(4-fluorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Smiles: CCCCOc1ccccc1c1nnc2n1N=C(CS2)c1ccc(cc1)F
STK967362
Synonyms: ethyl({5-[5-bromo-2-(pentyloxy)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Smiles: CCCCCOc1ccc(cc1c1nnc([nH]1)SCC(=O)OCC)Br
STK967383
Synonyms: 5-[(4-bromophenyl)sulfonyl]-2-(thiophen-2-yl)-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1S(=O)(=O)c1ccc(cc1)Br)c1cccs1
STK967385
Synonyms: N-{4-[(5-chloro-4-methyl-1,3-benzothiazol-2-yl)sulfamoyl]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1sc2c(n1)c(C)c(cc2)Cl
STK967386
Synonyms: 2-methyl-N-(2-methylpropyl)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-amine
Smiles: CC(CNc1nc(C)nc2c1c1CCCc1s2)C
STK967388
Synonyms: 3-[2-(dimethylamino)ethyl]-4-imino-3,4-dihydroquinazolin-2(1H)-one
Smiles: CN(CCn1c(=O)[nH]c2c(c1=N)cccc2)C
STK967389
Synonyms: 7-chloro-5-(4-fluorophenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one
Smiles: O=C1CN=C(c2c(N1)ccc(c2)Cl)c1ccc(cc1)F
STK967392
Synonyms: 5-[4-(diphenylmethyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1ncoc1N1CCN(CC1)C(c1ccccc1)c1ccccc1
STK967393
Synonyms: 4-methyl-1-[(2,4,5-trimethylphenyl)sulfonyl]-1H-imidazole
Smiles: Cc1ncn(c1)S(=O)(=O)c1cc(C)c(cc1C)C
STK967395
Synonyms: N-(4-{[4-(4-chlorophenyl)-1,3-thiazol-2-yl]sulfamoyl}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1scc(n1)c1ccc(cc1)Cl
STK967396
Synonyms: 2-oxo-N-(1,3-thiazol-2-yl)-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
Smiles: O=c1[nH]c2c(o1)cc(cc2)S(=O)(=O)Nc1nccs1
STK967397
Synonyms: 1,3-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)-2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonamide
Smiles: Cc1csc(n1)NS(=O)(=O)c1ccc2c(c1)n(C)c(=O)n2C
STK967398
Synonyms: 5-bromo-2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)Nc1noc(c1)C)Br
STK967400
Synonyms: 4-chloro-N-[(3-methyl-1,2-thiazol-5-yl)carbamoyl]benzamide
Smiles: O=C(NC(=O)c1ccc(cc1)Cl)Nc1snc(c1)C
STK967401
Synonyms: 1-(1,3,4-thiadiazol-2-yl)-3-[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]urea
Smiles: O=C(NC1(Oc2c(O1)cccc2)C(F)(F)F)Nc1nncs1
STK967409
Synonyms: N-(6-chloro-1,3-benzothiazol-2-yl)-4-(3,4-dihydroisoquinolin-2(1H)-yl)-4-oxobutanamide
Smiles: O=C(Nc1nc2c(s1)cc(cc2)Cl)CCC(=O)N1CCc2c(C1)cccc2
STK967410
Synonyms: N-(1-methyl-1H-pyrazol-3-yl)-1-phenylmethanesulfonamide
Smiles: Cn1ccc(n1)NS(=O)(=O)Cc1ccccc1
STK967411
Synonyms: 1-cyclohexyl-3-[1-(4-fluorobenzyl)-1H-pyrazol-3-yl]urea
Smiles: O=C(Nc1ccn(n1)Cc1ccc(cc1)F)NC1CCCCC1
STK967412
Synonyms: N-[1-(3-fluorobenzyl)-1H-pyrazol-3-yl]-2,5-dimethoxybenzenesulfonamide
Smiles: COc1ccc(c(c1)S(=O)(=O)Nc1ccn(n1)Cc1cccc(c1)F)OC
STK967413
Synonyms: N-(4-{[1-(2-methylbenzyl)-1H-pyrazol-4-yl]sulfamoyl}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1cnn(c1)Cc1ccccc1C
STK967414
Synonyms: 1-(2,4-difluorophenyl)-3-[1-(2-methylbenzyl)-1H-pyrazol-4-yl]urea
Smiles: O=C(Nc1ccc(cc1F)F)Nc1cnn(c1)Cc1ccccc1C
STK967415
Synonyms: 1-(4-methoxyphenyl)-3-[1-(2-methylbenzyl)-1H-pyrazol-4-yl]urea
Smiles: COc1ccc(cc1)NC(=O)Nc1cnn(c1)Cc1ccccc1C
STK967416
Synonyms: N-[1-(2-methylbenzyl)-1H-pyrazol-4-yl]quinoline-8-sulfonamide
Smiles: Cc1ccccc1Cn1ncc(c1)NS(=O)(=O)c1cccc2c1nccc2
STK967418
Synonyms: 1-[1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-3-cyclohexylurea
Smiles: O=C(Nc1c(C)nn(c1C)Cc1ccc(cc1)Br)NC1CCCCC1
STK967419
Synonyms: 1-[1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-3-(2,4-difluorophenyl)urea
Smiles: O=C(Nc1c(C)nn(c1C)Cc1ccc(cc1)Br)Nc1ccc(cc1F)F
STK967420
Synonyms: N-[1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-4-methoxybenzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)Nc1c(C)nn(c1C)Cc1ccc(cc1)Br
STK967421
Synonyms: 1-(2,4-difluorophenyl)-3-[1-(3-fluorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]urea
Smiles: O=C(Nc1c(C)nn(c1C)Cc1cccc(c1)F)Nc1ccc(cc1F)F
STK967422
Synonyms: N-(1-benzyl-1H-benzimidazol-2-yl)methanesulfonamide
Smiles: CS(=O)(=O)Nc1nc2c(n1Cc1ccccc1)cccc2
STK967423
Synonyms: 1-(2,4-difluorophenyl)-3-(1-ethyl-1H-benzimidazol-2-yl)urea
Smiles: CCn1c(NC(=O)Nc2ccc(cc2F)F)nc2c1cccc2
STK967424
Synonyms: 1-(2,5-dimethoxyphenyl)-3-(1-ethyl-1H-benzimidazol-2-yl)urea
Smiles: COc1ccc(c(c1)NC(=O)Nc1nc2c(n1CC)cccc2)OC
STK967425
Synonyms: 1-(1-ethyl-1H-benzimidazol-2-yl)-3-(3-methoxyphenyl)urea
Smiles: COc1cccc(c1)NC(=O)Nc1nc2c(n1CC)cccc2
STK967426
Synonyms: 1-(1-ethyl-1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)urea
Smiles: COc1ccc(cc1)NC(=O)Nc1nc2c(n1CC)cccc2
STK967427
Synonyms: 1-(1-ethyl-1H-benzimidazol-2-yl)-3-(2-methylphenyl)urea
Smiles: CCn1c(NC(=O)Nc2ccccc2C)nc2c1cccc2
STK967428
Synonyms: 4-methoxy-N-(1-propyl-1H-benzimidazol-2-yl)benzenesulfonamide
Smiles: CCCn1c(nc2c1cccc2)NS(=O)(=O)c1ccc(cc1)OC
STK967429
Synonyms: 1-cyclohexyl-3-(1-methyl-1H-benzimidazol-2-yl)urea
Smiles: O=C(Nc1nc2c(n1C)cccc2)NC1CCCCC1
STK967430
Synonyms: 1-(2-chlorophenyl)-3-(1-methyl-1H-benzimidazol-2-yl)urea
Smiles: O=C(Nc1nc2c(n1C)cccc2)Nc1ccccc1Cl
STK967431
Synonyms: 1-(2,4-difluorophenyl)-3-(1-methyl-1H-benzimidazol-2-yl)urea
Smiles: Fc1ccc(c(c1)F)NC(=O)Nc1nc2c(n1C)cccc2
STK967432
Synonyms: 1-(2,4-dimethylphenyl)-3-(1-methyl-1H-benzimidazol-2-yl)urea
Smiles: Cc1ccc(c(c1)C)NC(=O)Nc1nc2c(n1C)cccc2
STK967433
Synonyms: 1-(2,5-dimethoxyphenyl)-3-(1-methyl-1H-benzimidazol-2-yl)urea
Smiles: COc1ccc(c(c1)NC(=O)Nc1nc2c(n1C)cccc2)OC
STK967434
Synonyms: 1-(2,5-dimethylphenyl)-3-(1-methyl-1H-benzimidazol-2-yl)urea
Smiles: Cc1ccc(c(c1)NC(=O)Nc1nc2c(n1C)cccc2)C
STK967435
Synonyms: 3,4-dimethoxy-N-(1-methyl-1H-benzimidazol-2-yl)benzenesulfonamide
Smiles: COc1cc(ccc1OC)S(=O)(=O)Nc1nc2c(n1C)cccc2
STK967436
Synonyms: 3-cyano-N-(1-methyl-1H-benzimidazol-2-yl)benzamide
Smiles: N#Cc1cccc(c1)C(=O)Nc1nc2c(n1C)cccc2
STK967437
Synonyms: 1-(3-fluorophenyl)-3-(1-methyl-1H-benzimidazol-2-yl)urea
Smiles: Fc1cccc(c1)NC(=O)Nc1nc2c(n1C)cccc2
STK967438
Synonyms: 1-(3-methoxyphenyl)-3-(1-methyl-1H-benzimidazol-2-yl)urea
Smiles: COc1cccc(c1)NC(=O)Nc1nc2c(n1C)cccc2
STK967439
Synonyms: 4-fluoro-N-(1-methyl-1H-benzimidazol-2-yl)benzenesulfonamide
Smiles: Fc1ccc(cc1)S(=O)(=O)Nc1nc2c(n1C)cccc2
STK967440
Synonyms: 1-(4-methoxyphenyl)-3-(1-methyl-1H-benzimidazol-2-yl)urea
Smiles: COc1ccc(cc1)NC(=O)Nc1nc2c(n1C)cccc2
STK967441
Synonyms: 1-(1-methyl-1H-benzimidazol-2-yl)-3-[2-(trifluoromethyl)phenyl]urea
Smiles: O=C(Nc1ccccc1C(F)(F)F)Nc1nc2c(n1C)cccc2
STK967442
Synonyms: 1-(1-methyl-1H-benzimidazol-2-yl)-3-(3-methylphenyl)urea
Smiles: Cc1cccc(c1)NC(=O)Nc1nc2c(n1C)cccc2
STK967443
Synonyms: 1-(1-methyl-1H-benzimidazol-2-yl)-3-(2-methylphenyl)urea
Smiles: O=C(Nc1nc2c(n1C)cccc2)Nc1ccccc1C
STK967444
Synonyms: 1-(1-methyl-1H-benzimidazol-2-yl)-3-(4-methylphenyl)urea
Smiles: Cc1ccc(cc1)NC(=O)Nc1nc2c(n1C)cccc2
STK967445
Synonyms: N-(5-tert-butyl-1,2-oxazol-3-yl)-3-cyanobenzamide
Smiles: N#Cc1cccc(c1)C(=O)Nc1noc(c1)C(C)(C)C
STK967446
Synonyms: 4-chloro-N-(quinolin-5-yl)benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Nc1cccc2c1cccn2
STK967448
Synonyms: 1-[2-(trifluoromethyl)phenyl]-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)urea
Smiles: O=C(Nc1c(C)nn(c1C)C)Nc1ccccc1C(F)(F)F
STK967449
Synonyms: 1-(3-methylphenyl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)urea
Smiles: O=C(Nc1c(C)nn(c1C)C)Nc1cccc(c1)C
STK967450
Synonyms: N-(1,3,5-trimethyl-1H-pyrazol-4-yl)butane-1-sulfonamide
Smiles: CCCCS(=O)(=O)Nc1c(C)nn(c1C)C
STK967451
Synonyms: 2-[(benzylsulfonyl)amino]-5-(propan-2-yl)thiophene-3-carboxamide
Smiles: NC(=O)c1cc(sc1NS(=O)(=O)Cc1ccccc1)C(C)C
STK967452
Synonyms: 5-(propan-2-yl)-2-[(thiophen-2-ylsulfonyl)amino]thiophene-3-carboxamide
Smiles: NC(=O)c1cc(sc1NS(=O)(=O)c1cccs1)C(C)C
STK967453
Synonyms: 1-(1-ethyl-1H-pyrazol-3-yl)-3-phenylurea
Smiles: CCn1ccc(n1)NC(=O)Nc1ccccc1
STK967454
Synonyms: 1-(2,4-dimethylphenyl)-3-(1-ethyl-1H-pyrazol-3-yl)urea
Smiles: CCn1ccc(n1)NC(=O)Nc1ccc(cc1C)C
STK967455
Synonyms: 4-tert-butyl-N-(1-ethyl-1H-pyrazol-3-yl)benzenesulfonamide
Smiles: CCn1ccc(n1)NS(=O)(=O)c1ccc(cc1)C(C)(C)C
STK967457
Synonyms: 4,5-dimethyl-2-[(naphthalen-2-ylsulfonyl)amino]thiophene-3-carboxamide
Smiles: NC(=O)c1c(sc(c1C)C)NS(=O)(=O)c1ccc2c(c1)cccc2
STK967458
Synonyms: 4-(propan-2-yl)-N-(1,3,4-thiadiazol-2-yl)benzenesulfonamide
Smiles: CC(c1ccc(cc1)S(=O)(=O)Nc1nncs1)C
STK967459
Synonyms: N-(1,3,4-thiadiazol-2-yl)quinoline-8-sulfonamide
Smiles: O=S(=O)(c1cccc2c1nccc2)Nc1nncs1
STK967460
Synonyms: N-{4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl}pyridine-2-carboxamide
Smiles: Cc1onc(c1)NS(=O)(=O)c1ccc(cc1)NC(=O)c1ccccn1
STK967461
Synonyms: 4-[(benzylsulfonyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
Smiles: Cc1onc(c1)NS(=O)(=O)c1ccc(cc1)NS(=O)(=O)Cc1ccccc1
STK967462
Synonyms: 2-(4-bromophenyl)-N-{4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl}acetamide
Smiles: O=C(Cc1ccc(cc1)Br)Nc1ccc(cc1)S(=O)(=O)Nc1noc(c1)C
STK967463
Synonyms: 2-(1,3-benzodioxol-5-yloxy)-N-(2-methylquinolin-4-yl)acetamide
Smiles: O=C(Nc1cc(C)nc2c1cccc2)COc1ccc2c(c1)OCO2
STK967464
Synonyms: 4-[(4-bromo-1H-pyrazol-1-yl)methyl]-N-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)benzamide
Smiles: Brc1cnn(c1)Cc1ccc(cc1)C(=O)Nc1cc(=O)n(c(=O)n1C)C
STK967465
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-2,3-dimethyl-1H-indole-5-carboxamide
Smiles: O=C(c1ccc2c(c1)c(C)c([nH]2)C)NC1CCS(=O)(=O)C1
STK967466
Synonyms: N-(6-methoxy-1,3-benzothiazol-2-yl)-1,5-dimethyl-1H-pyrazole-3-carboxamide
Smiles: COc1ccc2c(c1)sc(n2)NC(=O)c1nn(c(c1)C)C
STK967467
Synonyms: 1-methyl-N-(2-methylquinolin-4-yl)-1H-pyrazole-3-carboxamide
Smiles: Cn1ccc(n1)C(=O)Nc1cc(C)nc2c1cccc2
STK967468
Synonyms: N-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-1-[(2-methylphenoxy)methyl]-1H-pyrazole-3-carboxamide
Smiles: O=C(c1ccn(n1)COc1ccccc1C)Nc1cc(=O)n(c(=O)n1C)C
STK967469
Synonyms: N-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-[(2-methylphenoxy)methyl]furan-2-carboxamide
Smiles: O=C(c1ccc(o1)COc1ccccc1C)Nc1cc(=O)n(c(=O)n1C)C
STK967470
Synonyms: 1-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-(4-cyanophenyl)-1H-pyrazole-3-carboxamide
Smiles: N#Cc1ccc(cc1)NC(=O)c1ccn(n1)Cn1nc(c(c1C)Br)C
STK967471
Synonyms: 1-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-1H-pyrazole-3-carboxamide
Smiles: O=C(c1ccn(n1)Cn1nc(c(c1C)Br)C)Nc1cc(=O)n(c(=O)n1C)C
STK967472
Synonyms: 3,5-dimethyl-N-(2-methylquinolin-4-yl)-1-phenyl-1H-pyrazole-4-carboxamide
Smiles: Cc1cc(NC(=O)c2c(C)nn(c2C)c2ccccc2)c2c(n1)cccc2
STK967473
Synonyms: 2,3-dimethyl-N-(4-sulfamoylphenyl)-1H-indole-5-carboxamide
Smiles: O=C(c1ccc2c(c1)c(C)c([nH]2)C)Nc1ccc(cc1)S(=O)(=O)N
STK967474
Synonyms: N-(2-methylquinolin-4-yl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide
Smiles: Cc1cc(NC(=O)c2ccc(o2)CN2CCCCC2)c2c(n1)cccc2
STK967475
Synonyms: 2-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-N-(pyridin-4-yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Br)C)Nc1ccncc1
STK967476
Synonyms: 2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-N-(2-methylquinolin-4-yl)acetamide
Smiles: Cc1cc(NC(=O)Cn2nc(c(c2C)Cl)C)c2c(n1)cccc2
STK967477
Synonyms: 6-cyclopropyl-N-(1,1-dioxidotetrahydrothiophen-3-yl)-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
Smiles: O=C(c1cc(nc2c1c(C)nn2C)C1CC1)NC1CCS(=O)(=O)C1
STK967478
Synonyms: 6-cyclopropyl-1,3-dimethyl-N-(5-methyl-1,3-thiazol-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
Smiles: Cc1cnc(s1)NC(=O)c1cc(nc2c1c(C)nn2C)C1CC1
STK967479
Synonyms: 6-cyclopropyl-1,3-dimethyl-N-(6-methyl-1,3-benzothiazol-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
Smiles: Cc1ccc2c(c1)sc(n2)NC(=O)c1cc(nc2c1c(C)nn2C)C1CC1
STK967481
Synonyms: furan-2-yl{4-[(1,3,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-4-yl)carbonyl]piperazin-1-yl}methanone
Smiles: Cc1cc(C(=O)N2CCN(CC2)C(=O)c2ccco2)c2c(n1)n(C)nc2C
STK967483
Synonyms: 1-methyl-N-(prop-2-en-1-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Smiles: C=CCNc1ncnc2c1cnn2C
STK967484
Synonyms: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]quinoline-2-carboxamide
Smiles: CC(Cc1nnc(s1)NC(=O)c1ccc2c(n1)cccc2)C
STK967485
Synonyms: 2-(pyridin-3-yl)-5-(trifluoromethoxy)-1H-benzimidazole
Smiles: FC(Oc1ccc2c(c1)nc([nH]2)c1cccnc1)(F)F
STK967505
Synonyms: 5-methyl-1,3-dihydro-2H-1,4-benzodiazepin-2-one
Smiles: O=C1CN=C(c2c(N1)cccc2)C
STK967506
Synonyms: N-(4-methoxy-2-methylphenyl)-1-propyl-1H-pyrazole-5-carboxamide
Smiles: CCCn1nccc1C(=O)Nc1ccc(cc1C)OC
STK967507
Synonyms: N-(4-bromo-2-fluorophenyl)-1-[(4-bromophenoxy)methyl]-1H-pyrazole-3-carboxamide
Smiles: Brc1ccc(cc1)OCn1ccc(n1)C(=O)Nc1ccc(cc1F)Br
STK967509
Synonyms: 1-[(4-bromophenoxy)methyl]-N-[1-(4-chlorobenzyl)-1H-pyrazol-3-yl]-1H-pyrazole-3-carboxamide
Smiles: Clc1ccc(cc1)Cn1ccc(n1)NC(=O)c1ccn(n1)COc1ccc(cc1)Br
STK967510
Synonyms: N-[1-(4-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
Smiles: Clc1ccc(cc1)Cn1nc(c(c1C)NC(=O)c1ccc(o1)Cn1nc(cc1C)C)C
STK967512
Synonyms: N-(1,3-benzothiazol-2-yl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
Smiles: O=S(=O)(c1ccc2c(c1)CCCC2)Nc1nc2c(s1)cccc2
STK967513
Synonyms: N-(4-{[1-(2,3-dihydro-1,4-benzodioxin-2-yl)ethyl]carbamoyl}phenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Smiles: CC(C1COc2c(O1)cccc2)NC(=O)c1ccc(cc1)NC(=O)C1COc2c(O1)cccc2
STK967514
Synonyms: N-[1-(2,3-dihydro-1,4-benzodioxin-2-yl)ethyl]-N'-(4-phenylbutan-2-yl)butanediamide
Smiles: CC(NC(=O)CCC(=O)NC(C1COc2c(O1)cccc2)C)CCc1ccccc1
STK967516
Synonyms: 6-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-N-(butan-2-yl)-N'-ethyl-1,3,5-triazine-2,4-diamine
Smiles: CCNc1nc(NC(CC)C)nc(n1)n1cnc(n1)SCc1ccccc1
STK967517
Synonyms: 6-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-N-tert-butyl-N'-ethyl-1,3,5-triazine-2,4-diamine
Smiles: CCNc1nc(nc(n1)n1cnc(n1)SCc1ccccc1)NC(C)(C)C
STK967518
Synonyms: N-{[2-(4-chlorophenyl)-1,3-thiazol-4-yl]acetyl}-L-tryptophan
Smiles: O=C(N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)Cc1csc(n1)c1ccc(cc1)Cl
STK967520
Synonyms: N-[3,5-dimethyl-1-(pentafluorobenzyl)-1H-pyrazol-4-yl]-1,3-dimethyl-1H-pyrazole-4-carboxamide
Smiles: Cn1nc(c(c1)C(=O)Nc1c(C)nn(c1C)Cc1c(F)c(F)c(c(c1F)F)F)C
STK967521
Synonyms: N-(3-chloro-2-methylphenyl)-2-{3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-methoxyphenyl)-5-oxo-2-thioxoimidazolidin-4-yl}acetamide
Smiles: COc1ccccc1N1C(=O)C(N(C1=S)CCc1ccc(c(c1)OC)OC)CC(=O)Nc1cccc(c1C)Cl
STK967522
Synonyms: (2E)-5-(4-chlorophenyl)-2-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-7-methyl-N-(2-methylphenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Smiles: Clc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)/c(=C\c1cn(nc1C)C)/s2)C(=O)Nc1ccccc1C
STK967527
Synonyms: (4-chloro-1,5-dimethyl-1H-pyrazol-3-yl)[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone
Smiles: CC1=NN(C(C1)(O)C(F)(F)F)C(=O)c1nn(c(c1Cl)C)C
STK967528
Synonyms: 1-{(E)-[(5-methyl-2,1,3-benzothiadiazol-4-yl)imino]methyl}naphthalen-2-ol
Smiles: Oc1ccc2c(c1/C=N/c1c(C)ccc3c1nsn3)cccc2
STK967530
Synonyms: 5-chloro-2-(2,4-dichlorophenyl)-1,3-benzoxazole
Smiles: Clc1ccc(c(c1)Cl)c1oc2c(n1)cc(cc2)Cl
STK967532
Synonyms: 3-bromo-5-(thiophen-2-yl)-N-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: O=C(c1nn2c(c1Br)nc(cc2C(F)(F)F)c1cccs1)NC12CC3CC(C2)CC(C1)C3
STK967533
Synonyms: 4-[(Z)-{2-[(3,4,5-trimethoxy-2-nitrophenyl)carbonyl]hydrazinylidene}methyl]phenylnaphthalene-1-carboxylate
Smiles: COc1cc(C(=O)N/N=C\c2ccc(cc2)OC(=O)c2cccc3c2cccc3)c(c(c1OC)OC)[N+](=O)[O-]
STK967534
Synonyms: 3-(3-chloro-1H-1,2,4-triazol-1-yl)-N-{1-[2-(piperidin-1-yl)ethyl]-1H-benzimidazol-2-yl}tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Smiles: Clc1ncn(n1)C12CC3CC(C1)CC(C2)(C3)C(=O)Nc1nc2c(n1CCN1CCCCC1)cccc2
STK967537
Synonyms: ethyl(2E)-5-(4-methoxyphenyl)-7-methyl-3-oxo-2-[(3-phenyl-1H-pyrazol-4-yl)methylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C\c1c[nH]nc1c1ccccc1)/s2
STK967539
Synonyms: N-(5-chloropyridin-2-yl)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxamide
Smiles: Clc1ccc(nc1)NC(=O)C12CCC(C2(C)C)(C(=O)O1)C
STK967540
Synonyms: prop-2-en-1-yl5-[4-(diethylamino)phenyl]-7-methyl-2,4-dioxo-1,2,3,4,5,8-hexahydropyrido[2,3-d]pyrimidine-6-carboxylate
Smiles: C=CCOC(=O)C1=C(C)Nc2c(C1c1ccc(cc1)N(CC)CC)c(=O)[nH]c(=O)[nH]2
STK967541
Synonyms: 2-ethoxy-5-{(E)-[2-(pyridin-4-yl)hydrazinylidene]methyl}phenol
Smiles: CCOc1ccc(cc1O)/C=N/Nc1ccncc1
STK967542
Synonyms: 3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N'-{3-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propanoyl}propanehydrazide
Smiles: O=C(CCn1nc(cc1C)C(F)(F)F)NNC(=O)CCn1nc(c(c1C)[N+](=O)[O-])C
STK967543
Synonyms: 3-amino-1-({5-[(2,5-dichlorophenoxy)methyl]furan-2-yl}carbonyl)-1H-pyrazole-4-carbonitrile
Smiles: N#Cc1cn(nc1N)C(=O)c1ccc(o1)COc1cc(Cl)ccc1Cl
STK967544
Synonyms: 1-ethyl-4-nitro-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl)-1H-pyrazole-5-carboxamide
Smiles: CCn1ncc(c1C(=O)NCC12CC3CC(C2)CC(C1)C3)[N+](=O)[O-]
STK967545
Synonyms: N-(furan-2-ylmethyl)-2,6-dimethylquinolin-4-amine
Smiles: Cc1ccc2c(c1)c(NCc1ccco1)cc(n2)C
STK967549
Synonyms: 2-bromo-N-({5-methyl-4-[4-(propan-2-yl)phenyl]-1,3-thiazol-2-yl}carbamothioyl)benzamide
Smiles: S=C(NC(=O)c1ccccc1Br)Nc1sc(c(n1)c1ccc(cc1)C(C)C)C
STK967551
Synonyms: 4-bromo-N-[3-(4-methoxyphenoxy)-5-nitrophenyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide
Smiles: COc1ccc(cc1)Oc1cc(NC(=O)c2n(C)nc(c2Br)C)cc(c1)[N+](=O)[O-]
STK967552
Synonyms: 5-[4-(propan-2-yl)phenyl]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1cnn2c1nc(cc2C(F)(F)F)c1ccc(cc1)C(C)C
STK967555
Synonyms: 1-(4-nitrophenyl)-N'~4~,N'~5~-bis[(E)-thiophen-2-ylmethylidene]-1H-1,2,3-triazole-4,5-dicarbohydrazide
Smiles: O=C(c1nnn(c1C(=O)N/N=C/c1cccs1)c1ccc(cc1)[N+](=O)[O-])N/N=C/c1cccs1
STK967556
Synonyms: 2-(2-bromo-6-ethoxy-4-{(Z)-[3-methyl-1-(4-methylphenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}phenoxy)-N-(2-methoxyphenyl)acetamide
Smiles: CCOc1cc(/C=C\2/C(=NN(C2=O)c2ccc(cc2)C)C)cc(c1OCC(=O)Nc1ccccc1OC)Br
STK967557
Synonyms: [5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl](4-methyloctahydroquinolin-1(2H)-yl)methanone
Smiles: COc1cc(ccc1OC)C1Nc2cc(nn2C(C1)C(F)(F)F)C(=O)N1CCC(C2C1CCCC2)C
STK967558
Synonyms: 4-cyano-5-[(cyclopropylcarbonyl)amino]-N,N,3-trimethylthiophene-2-carboxamide
Smiles: N#Cc1c(NC(=O)C2CC2)sc(c1C)C(=O)N(C)C
STK967560
Synonyms: 7-(difluoromethyl)-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}-5-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Smiles: COc1ccc(cc1)c1cc(C(F)F)n2c(n1)c(cn2)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nc(C)cc(n1)C
STK967561
Synonyms: N-(2-fluoro-5-methylphenyl)-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)acetamide
Smiles: O=C(Nc1cc(C)ccc1F)CC12CC3CC(C2)CC(C1)C3
STK967562
Synonyms: 5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-[1-(2,3,5,6-tetrafluorobenzyl)-1H-pyrazol-3-yl]furan-2-carboxamide
Smiles: O=C(c1ccc(o1)Cn1nc(c(c1C)Br)C)Nc1ccn(n1)Cc1c(F)c(F)cc(c1F)F
STK967566
Synonyms: 4-bromo-1,3-dimethyl-N-[(1-methyl-1H-pyrazol-5-yl)methyl]-1H-pyrazole-5-carboxamide
Smiles: O=C(c1n(C)nc(c1Br)C)NCc1ccnn1C
STK967569
Synonyms: 3,5-difluoro-N-(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)benzamide
Smiles: Fc1cc(F)cc(c1)C(=O)Nc1ccc2c(c1)[nH]c(=O)[nH]2
STK967570
Synonyms: 3-(cyclohexylcarbamoyl)bicyclo[2.2.1]hept-5-ene-2-carboxylicacid
Smiles: O=C(C1C2C=CC(C1C(=O)O)C2)NC1CCCCC1
STK967571
Synonyms: 2-[4-(5-amino-1H-benzimidazol-2-yl)phenyl]-1,3-benzoxazol-5-amine
Smiles: Nc1ccc2c(c1)nc(o2)c1ccc(cc1)c1nc2c([nH]1)ccc(c2)N
STK967573
Synonyms: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(1,1,2,2-tetrafluoroethoxy)benzamide
Smiles: N#Cc1c(NC(=O)c2cccc(c2)OC(C(F)F)(F)F)sc2c1CCC2
STK967575
Synonyms: 4-[(3-cyano-5-methyl-4-phenylthiophen-2-yl)amino]-4-oxobutanoicacid
Smiles: N#Cc1c(NC(=O)CCC(=O)O)sc(c1c1ccccc1)C
STK967577
Synonyms: 7-(difluoromethyl)-5-(4-methylphenyl)-N-[3-(morpholin-4-ylsulfonyl)phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
Smiles: Cc1ccc(cc1)c1cc(C(F)F)n2c(n1)c(cn2)C(=O)Nc1cccc(c1)S(=O)(=O)N1CCOCC1
STK967582
Synonyms: N-[(2Z)-2-[(3-chlorophenyl)imino]-4-phenyl-3-(prop-2-en-1-yl)-2,3-dihydro-1,3-thiazol-5-yl]acetamide
Smiles: C=CCn1/c(=N/c2cccc(c2)Cl)/sc(c1c1ccccc1)NC(=O)C
STK967583
Synonyms: 5-acetyl-6-(2,3-dichlorophenyl)-4-hydroxy-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one
Smiles: O=C1NC(c2cccc(c2Cl)Cl)C(C(N1)(O)C(F)(F)F)C(=O)C
STK967585
Synonyms: (2E)-7-methyl-3-oxo-N-phenyl-2-[(3-phenyl-1H-pyrazol-4-yl)methylidene]-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Smiles: O=C(C1=C(C)N=c2n(C1c1cccs1)c(=O)/c(=C\c1c[nH]nc1c1ccccc1)/s2)Nc1ccccc1
STK967588
Synonyms: N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-1-methyl-1H-pyrazole-3-carboxamide
Smiles: S=C(Nc1ccc(cc1)S(=O)(=O)NC(=N)N)NC(=O)c1ccn(n1)C
STK967589
Synonyms: (2-methoxy-4-{(E)-[2-(1H-tetrazol-5-yl)hydrazinylidene]methyl}phenoxy)acetonitrile
Smiles: N#CCOc1ccc(cc1OC)/C=N/Nc1nnn[nH]1
STK967591
Synonyms: 2,4-dihydroxy-N'-[(2E)-1-(3-nitro-1H-1,2,4-triazol-1-yl)propan-2-ylidene]benzohydrazide
Smiles: Oc1ccc(c(c1)O)C(=O)N/N=C(/Cn1cnc(n1)[N+](=O)[O-])\C
STK967595
Synonyms: diethyl3-methyl-5-[([1,2,4]triazolo[1,5-a]pyrimidin-2-ylcarbonyl)amino]thiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2nn3c(n2)nccc3)sc(c1C)C(=O)OCC
STK967596
Synonyms: N-{4-[acetyl(methyl)amino]phenyl}-4-iodo-1-methyl-1H-pyrazole-5-carboxamide
Smiles: CC(=O)N(c1ccc(cc1)NC(=O)c1c(I)cnn1C)C
STK967600
Synonyms: (5-bromo-6-oxo-1-phenyl-1,6-dihydropyridazin-4-yl)(1-ethyl-1H-benzimidazol-2-yl)acetonitrile
Smiles: N#CC(c1nc2c(n1CC)cccc2)c1cnn(c(=O)c1Br)c1ccccc1
STK967601
Synonyms: methyl2-({[4-(difluoromethoxy)-3-methoxyphenyl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COc1cc(ccc1OC(F)F)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2
STK967604
Synonyms: benzene-1,4-diylbis{[3-cyclopropyl-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone}
Smiles: O=C(N1N=C(CC1(O)C(F)(F)F)C1CC1)c1ccc(cc1)C(=O)N1N=C(CC1(O)C(F)(F)F)C1CC1
STK967607
Synonyms: N-[(3,5-dichlorophenyl)carbamothioyl]-1-methyl-1H-pyrazole-5-carboxamide
Smiles: S=C(NC(=O)c1ccnn1C)Nc1cc(Cl)cc(c1)Cl
STK967608
Synonyms: N-(1H-benzimidazol-2-yl)-2-(3-methylphenyl)quinoline-4-carboxamide
Smiles: Cc1cccc(c1)c1nc2ccccc2c(c1)C(=O)Nc1nc2c([nH]1)cccc2
STK967609
Synonyms: 2-(2-methoxyphenyl)-N-{4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl}quinoline-4-carboxamide
Smiles: COc1ccccc1c1nc2ccccc2c(c1)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1noc(c1)C
STK967610
Synonyms: (3,5-dimethyl-1H-pyrazol-1-yl){5-[(4-fluorophenoxy)methyl]furan-2-yl}methanone
Smiles: Fc1ccc(cc1)OCc1ccc(o1)C(=O)n1nc(cc1C)C
STK967611
Synonyms: 3,4-dihydroquinolin-1(2H)-yl(3-methylthiophen-2-yl)methanone
Smiles: Cc1ccsc1C(=O)N1CCCc2c1cccc2
STK967612
Synonyms: 2,2-dibromo-N-(6-ethoxy-1,3-benzothiazol-2-yl)-1-methylcyclopropanecarboxamide
Smiles: CCOc1ccc2c(c1)sc(n2)NC(=O)C1(C)CC1(Br)Br
STK967613
Synonyms: methyl5-[2-(difluoromethoxy)phenyl]-1,3,7-trimethyl-2,4-dioxo-1,2,3,4,5,8-hexahydropyrido[2,3-d]pyrimidine-6-carboxylate
Smiles: COC(=O)C1=C(C)Nc2c(C1c1ccccc1OC(F)F)c(=O)n(c(=O)n2C)C
STK967615
Synonyms: N-[2-nitro-3-(trifluoromethyl)phenyl]acetamide
Smiles: CC(=O)Nc1cccc(c1[N+](=O)[O-])C(F)(F)F
STK967617
Synonyms: 2-(1,5-dimethyl-1H-pyrazol-4-yl)-7-ethyl-2,3,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one
Smiles: CCN1CCc2c(C1)sc1c2C(=O)NC(N1)c1cnn(c1C)C
STK967618
Synonyms: dipropan-2-yl5-{[(5-{[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)oxy]methyl}furan-2-yl)carbonyl]amino}benzene-1,3-dicarboxylate
Smiles: CC(OC(=O)c1cc(cc(c1)C(=O)OC(C)C)NC(=O)c1ccc(o1)COn1nc(c(c1C)Br)C)C
STK967619
Synonyms: [3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl](1-methyl-1H-pyrazol-3-yl)methanone
Smiles: FC(C1(O)CC(=NN1C(=O)c1ccn(n1)C)C(F)F)F
STK967623
Synonyms: N'~4~,N'~5~-bis[(E)-(4-methoxyphenyl)methylidene]-1-(4-nitrophenyl)-1H-1,2,3-triazole-4,5-dicarbohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)c1c(nnn1c1ccc(cc1)[N+](=O)[O-])C(=O)N/N=C/c1ccc(cc1)OC
STK967625
Synonyms: N-[1-(2-chloro-6-fluorobenzyl)-1H-pyrazol-3-yl]-7-(difluoromethyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Smiles: Cc1ccc(cc1)c1cc(C(F)F)n2c(n1)c(cn2)C(=O)Nc1ccn(n1)Cc1c(F)cccc1Cl
STK967626
Synonyms: 6-chloro-7-hydroxy-8-[(4-methylpiperidin-1-yl)methyl]-4-phenyl-8,8a-dihydro-2H-chromen-2-one
Smiles: CC1CCN(CC1)CC1C(=C(Cl)C=C2C1OC(=O)C=C2c1ccccc1)O
STK967627
Synonyms: N-{2-[(E)-1-cyano-2-(3-hydroxyphenyl)ethenyl]-4-(4-methylphenyl)-1,3-thiazol-5-yl}furan-2-carboxamide
Smiles: N#C/C(=C\c1cccc(c1)O)/c1sc(c(n1)c1ccc(cc1)C)NC(=O)c1ccco1
STK967628
Synonyms: N-(2,4-dimethoxyphenyl)-6-methyl-3,4-dihydroquinoline-1(2H)-carbothioamide
Smiles: COc1cc(OC)ccc1NC(=S)N1CCCc2c1ccc(c2)C
STK967629
Synonyms: N-{4-[4-(morpholin-4-ylsulfonyl)phenyl]-1,3-thiazol-2-yl}acetamide
Smiles: CC(=O)Nc1scc(n1)c1ccc(cc1)S(=O)(=O)N1CCOCC1
STK967632
Synonyms: 4-chloro-1-methyl-N-[(2-methylquinolin-8-yl)carbamothioyl]-1H-pyrazole-5-carboxamide
Smiles: S=C(Nc1cccc2c1nc(C)cc2)NC(=O)c1c(Cl)cnn1C
STK967633
Synonyms: N-benzyl-5-oxo-3-phenylhexanamide
Smiles: O=C(CC(c1ccccc1)CC(=O)C)NCc1ccccc1
STK967634
Synonyms: 4-({2-[(3-bromophenyl)carbonyl]hydrazinyl}carbonyl)phenyl3-bromobenzoate
Smiles: Brc1cccc(c1)C(=O)NNC(=O)c1ccc(cc1)OC(=O)c1cccc(c1)Br
STK967635
Synonyms: N-(1-acetyl-2,2,4-trimethyl-4-phenyl-1,2,3,4-tetrahydroquinolin-6-yl)-2,2,2-trifluoroacetamide
Smiles: CC(=O)N1c2ccc(cc2C(CC1(C)C)(C)c1ccccc1)NC(=O)C(F)(F)F
STK967636
Synonyms: 2-{[(Z)-(4-hydroxy-2,6-dioxo-1-phenyl-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile
Smiles: N#Cc1c(N/C=C\2/C(=NC(=O)N(C2=O)c2ccccc2)O)sc2c1CCC2
STK967637
Synonyms: methyl4-(2-chlorophenyl)-2-[(trifluoroacetyl)amino]thiophene-3-carboxylate
Smiles: COC(=O)c1c(scc1c1ccccc1Cl)NC(=O)C(F)(F)F
STK967640
Synonyms: N,3a,6a-trimethylhexahydro-1H-1,4-methanocyclopenta[c]furan-1-carboxamide
Smiles: CNC(=O)C12OCC3(C2(C)CCC3C1)C
STK967641
Synonyms: 4-{[3-(ethoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamoyl}benzene-1,3-dicarboxylicacid
Smiles: CCOC(=O)c1c(NC(=O)c2ccc(cc2C(=O)O)C(=O)O)sc2c1CCCC2
STK967642
Synonyms: 2-{(2E)-2-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]hydrazinyl}pyridine
Smiles: Cn1nc(c(c1)/C=N/Nc1ccccn1)C
STK967645
Synonyms: 1-hydroxy-2-{(E)-[(4-hydroxybiphenyl-3-yl)imino]methyl}-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: N#Cc1c(C)c(/C=N/c2cc(ccc2O)c2ccccc2)c(n2c1nc1c2cccc1)O
STK967648
Synonyms: 2-({5-[(naphthalen-1-ylamino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N'-(1-phenylethylidene)acetohydrazide
Smiles: O=C(CSc1nnc(n1c1ccccc1)CNc1cccc2c1cccc2)N/N=C(/c1ccccc1)\C
STK967649
Synonyms: 1-{(E)-[(3,5-dimethyl-1H-pyrazol-4-yl)imino]methyl}naphthalen-2-ol
Smiles: Cc1[nH]nc(c1/N=C/c1c(O)ccc2c1cccc2)C
STK967652
Synonyms: methyl3-hydroxynaphthalene-1-carboxylate
Smiles: COC(=O)c1cc(O)cc2c1cccc2
STK967653
Synonyms: 2-[5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-(pentafluorophenyl)propanamide
Smiles: O=C(C(n1nc(cc1C1CC1)C(F)(F)F)C)Nc1c(F)c(F)c(c(c1F)F)F
STK967658
Synonyms: phenyl(1S,2R,3aR)-3,3-dicyano-2-(furan-3-yl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-1-carboxylate
Smiles: N#CC1(C#N)[C@H](c2cocc2)[C@H](N2[C@@H]1C=Cc1c2cccc1)C(=O)Oc1ccccc1
STK967659
Synonyms: 4-bromo-N-(3-cyano-4,5-dimethylthiophen-2-yl)-1-methyl-1H-pyrazole-3-carboxamide
Smiles: N#Cc1c(NC(=O)c2nn(cc2Br)C)sc(c1C)C
STK967660
Synonyms: (1Z)-1-{[5-(3-chlorophenyl)furan-2-yl]methylidene}-2-(3-methylphenyl)hydrazine
Smiles: Cc1cccc(c1)N/N=C\c1ccc(o1)c1cccc(c1)Cl
STK967661
Synonyms: N'-[(E)-(5-bromo-1H-indol-3-yl)methylidene]naphthalene-1-carbohydrazide
Smiles: Brc1ccc2c(c1)c(/C=N/NC(=O)c1cccc3c1cccc3)c[nH]2
STK967669
Synonyms: 4,4'-(biphenyl-4,4'-diyldisulfonyl)bis(2,6-dimethylmorpholine)
Smiles: CC1OC(C)CN(C1)S(=O)(=O)c1ccc(cc1)c1ccc(cc1)S(=O)(=O)N1CC(C)OC(C1)C
STK967670
Synonyms: 3-amino-1-({5-[(2-bromophenoxy)methyl]furan-2-yl}carbonyl)-1H-pyrazole-4-carbonitrile
Smiles: N#Cc1cn(nc1N)C(=O)c1ccc(o1)COc1ccccc1Br
STK967672
Synonyms: N-(4-{[1-(bicyclo[2.2.1]hept-2-yl)ethyl]sulfamoyl}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)NC(C1CC2CC1CC2)C
STK967673
Synonyms: 1,4-diphenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene
Smiles: c1ccc(cc1)c1cn2c3c1CCCCn3c(n2)c1ccccc1
STK967676
Synonyms: 4-{2-oxo-2-[phenyl(propan-2-yl)amino]ethyl}morpholin-4-ium
Smiles: CC(N(c1ccccc1)C(=O)C[NH+]1CCOCC1)C
STK967683
Synonyms: N-[(2Z)-4-(4-bromophenyl)-3-(4-methylpiperazin-1-yl)-1,3-thiazol-2(3H)-ylidene]-4-ethoxyaniline
Smiles: CCOc1ccc(cc1)/N=c/1\scc(n1N1CCN(CC1)C)c1ccc(cc1)Br
STK967684
Synonyms: [(2Z)-4-(4-tert-butylphenyl)-2-(phenylimino)-1,3-thiazol-3(2H)-yl](phenyl)methanone
Smiles: O=C(n1/c(=N/c2ccccc2)/scc1c1ccc(cc1)C(C)(C)C)c1ccccc1
STK967685
Synonyms: 3-[(2,4-dichlorophenoxy)methyl]-6-(4-fluorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Smiles: Fc1ccc(cc1)C1=Nn2c(SC1)nnc2COc1ccc(cc1Cl)Cl
STK967687
Synonyms: 2-{[(4-chlorophenyl)sulfanyl]methyl}imidazo[1,2-a]pyridine
Smiles: Clc1ccc(cc1)SCc1nc2n(c1)cccc2
STK967688
Synonyms: 6-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}imidazo[2,1-b][1,3]thiazole
Smiles: Cc1cc(C)nc(n1)SCc1cn2c(n1)scc2
STK967689
Synonyms: 1-{2-[(2Z)-2-(2-hydroxybenzylidene)hydrazinyl]-4-methyl-1,3-thiazol-5-yl}ethanone
Smiles: Oc1ccccc1/C=N\Nc1nc(c(s1)C(=O)C)C
STK967690
Synonyms: ethyl(2-{(2Z)-2-[4-(propan-2-yl)benzylidene]hydrazinyl}-1,3-thiazol-4-yl)acetate
Smiles: CCOC(=O)Cc1csc(n1)N/N=C\c1ccc(cc1)C(C)C
STK967691
Synonyms: 2-[(2Z)-2-(4-ethoxy-3-methoxybenzylidene)hydrazinyl]-1,3-thiazole
Smiles: CCOc1ccc(cc1OC)/C=N\Nc1nccs1
STK967692
Synonyms: (2E)-2-cyano-N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-phenylprop-2-enamide
Smiles: N#C/C(=C\c1ccccc1)/C(=O)Nc1nnc(s1)C
STK967693
Synonyms: ethyl5-(2-amino-2-oxoethoxy)-6-bromo-2-phenyl-1-benzofuran-3-carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCC(=O)N)c(c2)Br)c1ccccc1
STK967698
Synonyms: N-(4-chlorobenzyl)-2-methoxy-2,2-diphenylacetamide
Smiles: COC(c1ccccc1)(c1ccccc1)C(=O)NCc1ccc(cc1)Cl
STK967699
Synonyms: 5-[(4-methyl-2-nitrophenoxy)methyl]furan-2-carboxamide
Smiles: Cc1ccc(c(c1)[N+](=O)[O-])OCc1ccc(o1)C(=O)N
STK967700
Synonyms: N-(2-iodophenyl)-2-[1-(4-methoxyphenyl)-5-oxo-3-(pyridin-4-ylmethyl)-2-thioxoimidazolidin-4-yl]acetamide
Smiles: COc1ccc(cc1)N1C(=S)N(C(C1=O)CC(=O)Nc1ccccc1I)Cc1ccncc1
STK967701
Synonyms: (2Z)-2,3-diphenyl-N-[4-(1H-pyrazol-1-yl)benzyl]prop-2-enamide
Smiles: O=C(/C(=C\c1ccccc1)/c1ccccc1)NCc1ccc(cc1)n1cccn1
STK967705
Synonyms: 4-chloro-1-methyl-N-{[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioyl}-1H-pyrazole-5-carboxamide
Smiles: S=C(NC(=O)c1c(Cl)cnn1C)Nc1ccc(cc1)S(=O)(=O)Nc1nccs1
STK967708
Synonyms: 5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylicacid
Smiles: Brc1ccc(cc1)c1nc2cc(nn2c(c1)C(F)(F)F)C(=O)O
STK967710
Synonyms: methyl2-[(cyclopropylcarbonyl)amino]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)C2CC2)sc(c1C)C(=O)N(C)C
STK967712
Synonyms: 2-(2-{2-[(4-bromobenzyl)oxy]benzylidene}hydrazinyl)-N-(2-methoxyphenyl)-2-oxoacetamide
Smiles: COc1ccccc1NC(=O)C(=O)N/N=C/c1ccccc1OCc1ccc(cc1)Br
STK967713
Synonyms: 3-[(4Z)-4-(2-bromo-4-ethoxy-5-methoxybenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]propanenitrile
Smiles: CCOc1cc(Br)c(cc1OC)/C=C\1/C(=NN(C1=O)CCC#N)C
STK967716
Synonyms: methyl5-carbamoyl-4-methyl-2-({[(1R,3S,5R,7S)-3-(1H-1,2,4-triazol-1-yl)tricyclo[3.3.1.1~3,7~]dec-1-yl]carbonyl}amino)thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)[C@]23C[C@@H]4C[C@H](C2)C[C@](C3)(C4)n2cncn2)sc(c1C)C(=O)N
STK967723
Synonyms: 1,3,4,6-tetramethyl-1H-pyrazolo[3,4-d]pyrimidine
Smiles: Cc1nc(C)c2c(n1)n(C)nc2C
STK967724
Synonyms: 4-(5-methyl-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl)benzenesulfonate
Smiles: CC1CC(=NN1c1ccc(cc1)S(=O)(=O)[O-])c1ccccc1
STK967726
Synonyms: 6-amino-5-[2-(3,4-dimethoxyphenyl)ethyl]-7-(4-oxo-3,4-dihydroquinazolin-2-yl)-5H-pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile
Smiles: N#Cc1nc2c(nc1C#N)c(c(n2CCc1ccc(c(c1)OC)OC)N)c1nc2ccccc2c(=O)[nH]1
STK967728
Synonyms: 7-hydroxy-8-[(4-methylpiperidin-1-yl)methyl]-3-phenyl-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: CC1CCN(CC1)Cc1c(O)ccc2c1oc(c(c2=O)c1ccccc1)C(F)(F)F
STK967729
Synonyms: 5-[(3-methoxypropyl)amino]-6-methyl-1,2,4-triazin-3(2H)-one
Smiles: Cc1n[nH]c(=O)nc1NCCCOC
STK967730
Synonyms: methyl2-{[(6-bromo-2-oxo-2H-chromen-3-yl)carbonyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)c2cc3cc(Br)ccc3oc2=O)sc2c1CCC(C2)C
STK967732
Synonyms: (5-bromo-6-oxo-1-phenyl-1,6-dihydropyridazin-4-yl)(1-methyl-1H-benzimidazol-2-yl)acetonitrile
Smiles: N#CC(c1nc2c(n1C)cccc2)c1cnn(c(=O)c1Br)c1ccccc1
STK967733
Synonyms: 6-butyl-3-(2-methyl-1,3-thiazol-4-yl)-4-oxo-4H-chromen-7-ylformate
Smiles: CCCCc1cc2c(cc1OC=O)occ(c2=O)c1csc(n1)C
STK967734
Synonyms: 2-{2-[(trifluoromethyl)sulfanyl]ethyl}-2,3-dihydro-1H-isoindol-1-imine
Smiles: N=C1N(CCSC(F)(F)F)Cc2c1cccc2
STK967735
Synonyms: 1-phenyl-3-[(1E)-2-phenyl-2,3-dihydro-1H-isoindol-1-ylidene]urea
Smiles: O=C(/N=C\1/N(Cc2c1cccc2)c1ccccc1)Nc1ccccc1
STK967736
Synonyms: N~2~-benzyl-N-(2-methoxyphenyl)asparagine
Smiles: COc1ccccc1NC(=O)CC(C(=O)O)NCc1ccccc1
STK967737
Synonyms: ethyl5-(2-hydroxyphenyl)-7-methyl-2,4-dioxo-1,2,3,4,5,8-hexahydropyrido[2,3-d]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)Nc2c(C1c1ccccc1O)c(=O)[nH]c(=O)[nH]2
STK967738
Synonyms: prop-2-en-1-yl7-methyl-2,4-dioxo-5-(thiophen-2-yl)-1,2,3,4,5,8-hexahydropyrido[2,3-d]pyrimidine-6-carboxylate
Smiles: C=CCOC(=O)C1=C(C)Nc2c(C1c1cccs1)c(=O)[nH]c(=O)[nH]2
STK967739
Synonyms: 3-[3-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-2-hydroxypropyl]-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane-2,4-dione
Smiles: OC(Cn1nc(c(c1C)Br)C)CN1C(=O)C2CCC(C1=O)(C2(C)C)C
STK967740
Synonyms: 1-[(5-bromo-2-methoxyphenyl)sulfonyl]-4-(3-chloro-4-methylphenyl)piperazine
Smiles: COc1ccc(cc1S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)Cl)C)Br
STK967742
Synonyms: 2-{[5-(4-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{2-[(4-nitrobenzyl)oxy]benzylidene}acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Br)N/N=C\c1ccccc1OCc1ccc(cc1)[N+](=O)[O-]
STK967743
Synonyms: 2-(2-cyclohexylidenehydrazinyl)pyridine
Smiles: C1CCC(=NNc2ccccn2)CC1
STK967746
Synonyms: ethyl4-hydroxy-6-(3-hydroxyphenyl)-2-oxo-4-(trifluoromethyl)hexahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1C(NC(=O)NC1(O)C(F)(F)F)c1cccc(c1)O
STK967747
Synonyms: 3-methoxyphenyl[5-chloro-2-(trifluoromethyl)-1,3-benzodioxol-2-yl]carbamate
Smiles: COc1cccc(c1)OC(=O)NC1(Oc2c(O1)ccc(c2)Cl)C(F)(F)F
STK967748
Synonyms: (1Z)-N'-benzyl-2,2,2-trifluoro-N-(phenylsulfonyl)ethanimidamide
Smiles: FC(/C(=N/Cc1ccccc1)/NS(=O)(=O)c1ccccc1)(F)F
STK967749
Synonyms: 1-(2,6-dimethylpiperidin-1-yl)-3-[3-methyl-4-(propan-2-yl)phenoxy]propan-2-ol
Smiles: OC(CN1C(C)CCCC1C)COc1ccc(c(c1)C)C(C)C
STK967750
Synonyms: [5-(4-bromophenyl)-2H-tetrazol-2-yl](3-methoxyphenyl)methanone
Smiles: COc1cccc(c1)C(=O)n1nnc(n1)c1ccc(cc1)Br
STK967751
Synonyms: 2,2,2-trifluoro-N-[(2Z)-2-(1,3,3-trimethyl-1,3-dihydro-2H-indol-2-ylidene)acetyl]acetamide
Smiles: O=C(/C=C/1\N(C)c2c(C1(C)C)cccc2)NC(=O)C(F)(F)F
STK967752
Synonyms: methyl3-acetyl-4-(2-methoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: COC(=O)C1=C(C)NC(=O)N(C1c1ccccc1OC)C(=O)C
STK967753
Synonyms: 3-[2-(morpholin-4-yl)ethyl]-2-phenyl-1,3-thiazolidin-4-one
Smiles: O=C1CSC(N1CCN1CCOCC1)c1ccccc1
STK967754
Synonyms: ethyl8-methoxy-4-{[4-(piperidin-1-yl)phenyl]amino}quinoline-3-carboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccc(cc1)N1CCCCC1)cccc2OC
STK967755
Synonyms: 8-amino-6-tert-butyltetrazolo[1,5-b][1,2,4]triazin-7(8H)-one
Smiles: Nn1c(=O)c(nn2c1nnn2)C(C)(C)C
STK967756
Synonyms: 1-(difluoromethyl)-2-methyl-3-(2-oxo-2-phenylethyl)-1H-3,1-benzimidazol-3-ium
Smiles: O=C(c1ccccc1)C[n+]1c2ccccc2n(c1C)C(F)F
STK967757
Synonyms: N-phenyl-2H-1,4-benzoxazin-3-amine
Smiles: c1ccc(cc1)NC1=Nc2c(OC1)cccc2
STK967758
Synonyms: (5Z)-5-[2-(2,4-dimethylphenyl)-2-oxoethylidene]-1,3-thiazolidine-2,4-dione
Smiles: O=C1NC(=O)/C(=C/C(=O)c2ccc(cc2C)C)/S1
STK967759
Synonyms: 1-(2-tert-butylphenoxy)-3-[(1-phenylethyl)amino]propan-2-ol
Smiles: OC(COc1ccccc1C(C)(C)C)CNC(c1ccccc1)C
STK967760
Synonyms: 4-({[(2E)-4-oxo-2-{(2E)-[(2E)-3-phenylprop-2-en-1-ylidene]hydrazinylidene}-1,3-thiazolidin-5-yl]acetyl}amino)butanoicacid
Smiles: O=C(CC1S/C(=N/N=C/C=C/c2ccccc2)/NC1=O)NCCCC(=O)O
STK967761
Synonyms: 2-[(6-bromoquinazolin-4-yl)amino]-4-chlorophenol
Smiles: Clc1ccc(c(c1)Nc1ncnc2c1cc(Br)cc2)O
STK967762
Synonyms: 11H-isoindolo[2,1-a]benzimidazole
Smiles: c1ccc2c(c1)Cn1c2nc2c1cccc2
STK967763
Synonyms: 5-[(2E)-2-(2,4-dichlorobenzylidene)hydrazinyl]-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1ncoc1N/N=C/c1ccc(cc1Cl)Cl
STK967764
Synonyms: 1,3,5-trimethyl-N-[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)propyl]-1H-pyrazole-4-carboxamide
Smiles: CCC(C12CC3CC(C2)CC(C1)C3)NC(=O)c1c(C)nn(c1C)C
STK967765
Synonyms: 4-bromo-N-(2,3-dimethylcyclohexyl)-1-ethyl-1H-pyrazole-5-carboxamide
Smiles: CCn1ncc(c1C(=O)NC1CCCC(C1C)C)Br
STK967766
Synonyms: 5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)furan-2-carboxamide
Smiles: O=C(c1ccc(o1)Cn1nc(c(c1C)Br)C)Nc1c(C)nn(c1C)C
STK967767
Synonyms: N-[(3,4-difluorophenyl)carbonyl]glycine
Smiles: OC(=O)CNC(=O)c1ccc(c(c1)F)F
STK967768
Synonyms: 2-[(5Z)-5-{[1-(4-nitrophenyl)-3-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]ethanesulfonicacid
Smiles: S=C1S/C(=C\c2cn(nc2c2ccccc2)c2ccc(cc2)[N+](=O)[O-])/C(=O)N1CCS(=O)(=O)O
STK967769
Synonyms: 3,3'-[(9-propyl-9H-carbazol-3-yl)methanediyl]bis(4-hydroxy-2H-chromen-2-one)
Smiles: CCCn1c2ccc(cc2c2c1cccc2)C(c1c(=O)oc2c(c1O)cccc2)c1c(=O)oc2c(c1O)cccc2
STK967770
Synonyms: 3-{[(4-chlorophenyl)carbamoyl]amino}-N-(2-methoxyphenyl)-4-(morpholin-4-yl)benzenesulfonamide
Smiles: COc1ccccc1NS(=O)(=O)c1ccc(c(c1)NC(=O)Nc1ccc(cc1)Cl)N1CCOCC1
STK967771
Synonyms: N-(3-chlorophenyl)-2-(8-chloroquinolin-4-yl)hydrazinecarboxamide
Smiles: O=C(Nc1cccc(c1)Cl)NNc1ccnc2c1cccc2Cl
STK967772
Synonyms: (5Z)-3-(3-hydroxyphenyl)-5-[(1-methyl-1H-indol-3-yl)methylidene]-1,3-thiazolidine-2,4-dione
Smiles: Oc1cccc(c1)N1C(=O)S/C(=C\c2cn(c3c2cccc3)C)/C1=O
STK967773
Synonyms: 1-[bis(2-hydroxyethyl)amino]-3-[(9H-fluoren-9-ylideneamino)oxy]propan-2-ol
Smiles: OCCN(CC(CO/N=C/1\c2ccccc2c2c1cccc2)O)CCO
STK967774
Synonyms: N-{5-[4-(piperidin-1-ylsulfonyl)phenyl]-1,3-thiazol-2-yl}thiophene-2-carboxamide
Smiles: O=C(c1cccs1)Nc1ncc(s1)c1ccc(cc1)S(=O)(=O)N1CCCCC1
STK967775
Synonyms: 4-(1H-indol-3-yl)-6-(5,6,7,8-tetrahydronaphthalen-2-yl)-4,5-dihydropyridazin-3(2H)-one
Smiles: O=C1NN=C(CC1c1c[nH]c2c1cccc2)c1ccc2c(c1)CCCC2
STK967776
Synonyms: ethyl4-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(trifluoromethyl)quinazoline-6-carboxylate
Smiles: CCOC(=O)c1ccc2c(c1)c(nc(n2)C(F)(F)F)N1CCc2c(C1)cccc2
STK967777
Synonyms: 2-oxo-4-(thiophen-2-yl)-5-(thiophen-2-ylcarbonyl)-6-(trifluoromethyl)-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(=O)[nH]c(c(c1c1cccs1)C(=O)c1cccs1)C(F)(F)F
STK967780
Synonyms: (5E)-5-{[5-(4-bromophenyl)furan-2-yl]methylidene}-3-(propan-2-yl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CC(N1C(=S)S/C(=C/c2ccc(o2)c2ccc(cc2)Br)/C1=O)C
STK967781
Synonyms: N-cycloheptyl-4-iodo-1-methyl-1H-pyrazole-5-carboxamide
Smiles: O=C(c1c(I)cnn1C)NC1CCCCCC1
STK967783
Synonyms: 2-(4-bromophenoxy)-1-(4-chloro-1H-pyrazol-1-yl)ethanone
Smiles: Brc1ccc(cc1)OCC(=O)n1ncc(c1)Cl
STK967784
Synonyms: [5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl](4-methyloctahydroquinolin-1(2H)-yl)methanone
Smiles: COc1cc(ccc1OC)c1nc2cc(nn2c(c1)C(F)(F)F)C(=O)N1CCC(C2C1CCCC2)C
STK967785
Synonyms: 11-chloro-N-[1-(4-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-7-(trifluoromethyl)-5,6-dihydrobenzo[h]pyrazolo[5,1-b]quinazoline-10-carboxamide
Smiles: Clc1ccc(cc1)Cn1nc(c(c1C)NC(=O)c1nn2c(c1Cl)nc1c(c2C(F)(F)F)CCc2c1cccc2)C
STK967788
Synonyms: 6-(4-methylphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Smiles: Cc1ccc(cc1)C1=Nn2c(SC1)nnc2
STK967790
Synonyms: 1-(4-fluorophenyl)-4-{[(4-fluorophenyl)amino]methyl}-N-(pyridin-2-yl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Fc1ccc(cc1)NCc1cn2c3n1CCCCc3c(c2C(=O)Nc1ccccn1)c1ccc(cc1)F
STK967791
Synonyms: 5-acetyl-6-[4-(benzyloxy)-3-ethoxyphenyl]-4-hydroxy-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one
Smiles: CCOc1cc(ccc1OCc1ccccc1)C1NC(=O)NC(C1C(=O)C)(O)C(F)(F)F
STK967792
Synonyms: 7-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylicacid
Smiles: O=C1C(NC(=O)c2c(Br)cnn2C)C2N1C(=C(CS2)C)C(=O)O
STK967796
Synonyms: 4-bromo-N-[1-(1-ethyl-3-methyl-1H-pyrazol-4-yl)ethyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide
Smiles: CCn1nc(c(c1)C(NC(=O)c1n(C)nc(c1Br)C)C)C
STK967797
Synonyms: 4-chloro-N-[(1-methyl-1H-pyrazol-5-yl)methyl]-5-nitro-1H-pyrazole-3-carboxamide
Smiles: O=C(c1n[nH]c(c1Cl)[N+](=O)[O-])NCc1ccnn1C
STK967798
Synonyms: N,N,P,P-tetraphenylphosphinicamide
Smiles: O=P(N(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
STK967800
Synonyms: (2E)-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(1,5-dimethyl-1H-pyrazol-4-yl)prop-2-enamide
Smiles: N#Cc1c(NC(=O)/C=C/c2cnn(c2C)C)sc2c1CCC(C2)C(C)(C)C
STK967801
Synonyms: N-(2-benzylphenyl)-7-(difluoromethyl)-5-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Smiles: COc1ccc(cc1)c1cc(C(F)F)n2c(n1)c(cn2)C(=O)Nc1ccccc1Cc1ccccc1
STK967802
Synonyms: 5,5'-(2-phenylethene-1,1-diyl)bis[1-(4-chlorophenyl)-1H-tetrazole]
Smiles: Clc1ccc(cc1)n1nnnc1/C(=C/c1ccccc1)/c1nnnn1c1ccc(cc1)Cl
STK967803
Synonyms: N-(5-chloro-2-hydroxyphenyl)-5,7-bis(difluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: Clc1ccc(c(c1)NC(=O)c1nn2c(c1)nc(cc2C(F)F)C(F)F)O
STK967806
Synonyms: 3-chloro-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: N#Cc1c(NC(=O)c2nn3c(c2Cl)nc(cc3C(F)(F)F)c2cccs2)sc2c1CCC(C2)C
STK967808
Synonyms: 2-(piperidin-1-yl)ethyl5-[(4-ethoxyphenoxy)methyl]furan-2-carboxylate
Smiles: CCOc1ccc(cc1)OCc1ccc(o1)C(=O)OCCN1CCCCC1
STK967809
Synonyms: 5-(4-bromophenyl)-N-(tetrahydrofuran-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: Brc1ccc(cc1)C1Nc2cc(nn2C(C1)C(F)(F)F)C(=O)NCC1CCCO1
STK967810
Synonyms: 5-(4-bromophenyl)-N-(1-phenylethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Smiles: Brc1ccc(cc1)C1CC(n2c(N1)c(cn2)C(=O)NC(c1ccccc1)C)C(F)(F)F
STK967811
Synonyms: ethyl2-amino-4-{3-methoxy-4-[(4-methoxyphenoxy)methyl]phenyl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Smiles: CCOC(=O)C1=C(N)OC2=C(C1c1ccc(c(c1)OC)COc1ccc(cc1)OC)C(=O)CC(C2)(C)C
STK967812
Synonyms: methyl2-amino-4-{5-[(4-bromophenoxy)methyl]furan-2-yl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Smiles: COC(=O)C1=C(N)OC2=C(C1c1ccc(o1)COc1ccc(cc1)Br)C(=O)CCC2
STK967814
Synonyms: N-[(E)-(3-bromo-4-methoxyphenyl)methylidene]-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine
Smiles: COc1ccc(cc1Br)/C=N/c1nc2c(s1)CCCC2
STK967815
Synonyms: 1-{4-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-2-hydroxypropoxy]phenyl}ethanone
Smiles: OC(CN1CCc2c(C1)cccc2)COc1ccc(cc1)C(=O)C
STK967818
Synonyms: 5-methyl-2-(propan-2-yl)phenyl(trifluoroacetyl)carbamate
Smiles: O=C(Oc1cc(C)ccc1C(C)C)NC(=O)C(F)(F)F
STK967819
Synonyms: ethyl4-{[4-(dimethylamino)phenyl]amino}benzo[h]quinoline-3-carboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccc(cc1)N(C)C)ccc1c2cccc1
STK967820
Synonyms: 5-{(2E)-2-[4-(pentyloxy)benzylidene]hydrazinyl}-1,3-oxazole-4-carbonitrile
Smiles: CCCCCOc1ccc(cc1)/C=N/Nc1ocnc1C#N
STK967821
Synonyms: 5-[(2E)-2-{[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}hydrazinyl]-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1ncoc1N/N=C/c1cn(nc1c1cccc(c1)[N+](=O)[O-])c1ccccc1
STK967822
Synonyms: N-benzyl-4-[(4-methylphenyl)sulfonyl]-2-(propan-2-yl)-1,3-oxazol-5-amine
Smiles: Cc1ccc(cc1)S(=O)(=O)c1nc(oc1NCc1ccccc1)C(C)C
STK967825
Synonyms: 1-[2-(difluoromethoxy)phenyl]-3-(2-phenylethyl)thiourea
Smiles: S=C(Nc1ccccc1OC(F)F)NCCc1ccccc1
STK967827
Synonyms: 3,3-dimethyl-8-(morpholin-4-yl)-6-thioxo-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
Smiles: N#Cc1c(=S)[nH]c(c2c1CC(C)(C)SC2)N1CCOCC1
STK967830
Synonyms: 4-(1,3-benzoxazol-2-ylsulfanyl)-3-oxo-2-phenylbutanenitrile
Smiles: N#CC(c1ccccc1)C(=O)CSc1nc2c(o1)cccc2
STK967832
Synonyms: ethyl2-[({[5-(4-chloro-1,5-dimethyl-1H-pyrazol-3-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4,5-dimethylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nnc(n2c2ccccc2OC)c2nn(c(c2Cl)C)C)sc(c1C)C
STK967833
Synonyms: 4-bromo-1-ethyl-N-[3-(morpholin-4-yl)propyl]-1H-pyrazole-5-carboxamide
Smiles: CCn1ncc(c1C(=O)NCCCN1CCOCC1)Br
STK967834
Synonyms: 3-{(4Z)-4-[2-bromo-5-methoxy-4-(propan-2-yloxy)benzylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}propanenitrile
Smiles: N#CCCN1N=C(/C(=C/c2cc(OC)c(cc2Br)OC(C)C)/C1=O)C
STK967835
Synonyms: 1-ethyl-N-(4-sulfamoylphenyl)-1H-pyrazole-5-carboxamide
Smiles: CCn1nccc1C(=O)Nc1ccc(cc1)S(=O)(=O)N
STK967836
Synonyms: 1-(2-tert-butylphenoxy)-3-(2,6-dimethylmorpholin-4-yl)propan-2-ol
Smiles: OC(CN1CC(C)OC(C1)C)COc1ccccc1C(C)(C)C
STK967837
Synonyms: 2-(pentafluorophenyl)-1,3-thiazolidine-4-carboxylicacid
Smiles: OC(=O)C1CSC(N1)c1c(F)c(F)c(c(c1F)F)F
STK967838
Synonyms: 1-{4-[5-(2,5-dichlorophenyl)furan-2-yl]-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl}ethanone
Smiles: S=C1NC(c2ccc(o2)c2cc(Cl)ccc2Cl)C(=C(N1)c1ccccc1)C(=O)C
STK967839
Synonyms: N-[1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: Brc1ccc(cc1)Cn1nc(c(c1C)NC(=O)c1cc2n(n1)C(CC(N2)c1ccccc1)C(F)(F)F)C
STK967840
Synonyms: ethyl2-amino-4-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Smiles: CCOC(=O)C1=C(N)OC2=C(C1c1c(C)nn(c1C)CC)C(=O)CCC2
STK967842
Synonyms: methyl2-[({[5-(4-chloro-1-methyl-1H-pyrazol-3-yl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)CSc2nnc(n2c2ccc(cc2)C)c2nn(cc2Cl)C)sc2c1CCCC2
STK967848
Synonyms: N-(6-bromo-1,3-benzothiazol-2-yl)-4-chlorobenzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Nc1nc2c(s1)cc(cc2)Br
STK967849
Synonyms: 2-(2,3-dichlorophenoxy)-1-(1H-pyrazol-1-yl)ethanone
Smiles: Clc1cccc(c1Cl)OCC(=O)n1cccn1
STK967850
Synonyms: [3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl](pyridin-4-yl)methanone
Smiles: FC(C1(O)CC(=NN1C(=O)c1ccncc1)C(F)F)F
STK967851
Synonyms: {3-[(4-bromophenoxy)methyl]phenyl}(2,3-dihydro-1H-indol-1-yl)methanone
Smiles: Brc1ccc(cc1)OCc1cccc(c1)C(=O)N1CCc2c1cccc2
STK967854
Synonyms: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-4-(difluoromethoxy)-3-methoxybenzamide
Smiles: COc1cc(ccc1OC(F)F)C(=O)Nc1sc2c(c1C#N)CCC2
STK967857
Synonyms: 1-(4-bromophenyl)-2-[(5,5-dimethyl-4,5-dihydro-1,3-thiazol-2-yl)(phenyl)amino]ethanone
Smiles: Brc1ccc(cc1)C(=O)CN(c1ccccc1)C1=NCC(S1)(C)C
STK967865
Synonyms: 5,7-dimethyl-2-{[(4-methylphenyl)sulfanyl]methyl}imidazo[1,2-a]pyrimidine
Smiles: Cc1ccc(cc1)SCc1nc2n(c1)c(C)cc(n2)C
STK967866
Synonyms: N-[(E)-(dimethylamino)methylidene]-9-pentofuranosyl-9H-purin-6-amine
Smiles: OCC1OC(C(C1O)O)n1cnc2c1ncnc2/N=C/N(C)C
STK967867
Synonyms: N,N-dimethyl-4-(8-methylimidazo[1,2-a]pyridin-2-yl)benzenesulfonamide
Smiles: Cc1cccn2c1nc(c2)c1ccc(cc1)S(=O)(=O)N(C)C
STK967868
Synonyms: 2-{1-[(4-chlorophenoxy)acetyl]-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl}-N-(2-ethoxyphenyl)acetamide
Smiles: CCOc1ccccc1NC(=O)CC1C(=O)Nc2c(N1C(=O)COc1ccc(cc1)Cl)cccc2
STK967869
Synonyms: 1-{5-[3-(diethylamino)-2-hydroxypropoxy]-2-methyl-1-phenyl-1H-indol-3-yl}ethanone
Smiles: CCN(CC(COc1ccc2c(c1)c(C(=O)C)c(n2c1ccccc1)C)O)CC
STK967870
Synonyms: 1,7,7-trimethyl-4-[(2-methylpiperidin-1-yl)carbonyl]bicyclo[2.2.1]heptan-2-one
Smiles: CC1CCCCN1C(=O)C12CCC(C2(C)C)(C(=O)C1)C
STK967871
Synonyms: 4,7,7-trimethyl-1-[(3-methylpiperidin-1-yl)carbonyl]-2-oxabicyclo[2.2.1]heptan-3-one
Smiles: CC1CCCN(C1)C(=O)C12CCC(C2(C)C)(C(=O)O1)C
STK967872
Synonyms: 4,7,7-trimethyl-3-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2-oxabicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)O1)C)NC1CC(C)(C)NC(C1)(C)C
STK967873
Synonyms: 1,7,7-trimethyl-4-[(3-methylpiperidin-1-yl)carbonyl]bicyclo[2.2.1]heptan-2-one
Smiles: CC1CCCN(C1)C(=O)C12CCC(C2(C)C)(C(=O)C1)C
STK967874
Synonyms: 4,7,7-trimethyl-1-[(4-methylpiperidin-1-yl)carbonyl]-2-oxabicyclo[2.2.1]heptan-3-one
Smiles: CC1CCN(CC1)C(=O)C12CCC(C2(C)C)(C(=O)O1)C
STK967875
Synonyms: N-(furan-2-ylmethyl)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)O1)C)NCc1ccco1
STK967876
Synonyms: N,N'-pentane-1,5-diylbis(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxamide)
Smiles: O=C(C12CCC(C2(C)C)(C(=O)O1)C)NCCCCCNC(=O)C12CCC(C2(C)C)(C(=O)O1)C
STK967877
Synonyms: 1,7,7-trimethyl-4-[(4-methylpiperidin-1-yl)carbonyl]bicyclo[2.2.1]heptan-2-one
Smiles: CC1CCN(CC1)C(=O)C12CCC(C2(C)C)(C(=O)C1)C
STK967878
Synonyms: 4,7,7-trimethyl-1-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)carbonyl]-2-oxabicyclo[2.2.1]heptan-3-one
Smiles: O=C(C12CCC(C2(C)C)(C(=O)O1)C)N1CC2(CC1CC(C2)(C)C)C
STK967879
Synonyms: 1,1'-(piperazine-1,4-diyldicarbonyl)bis(4,7,7-trimethyl-2-oxabicyclo[2.2.1]heptan-3-one)
Smiles: O=C(C12CCC(C2(C)C)(C(=O)O1)C)N1CCN(CC1)C(=O)C12CCC(C2(C)C)(C(=O)O1)C
STK967880
Synonyms: 4-[(2-ethylpiperidin-1-yl)carbonyl]-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one
Smiles: CCC1CCCCN1C(=O)C12CCC(C2(C)C)(C(=O)C1)C
STK967881
Synonyms: 4,7,7-trimethyl-3-oxo-N'-phenylbicyclo[2.2.1]heptane-1-carbohydrazide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1)C)NNc1ccccc1
STK967883
Synonyms: 4-(3,4-dihydroisoquinolin-2(1H)-ylcarbonyl)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1)C)N1CCc2c(C1)cccc2
STK967884
Synonyms: 4,7,7-trimethyl-1-[(2-methylpiperidin-1-yl)carbonyl]-2-oxabicyclo[2.2.1]heptan-3-one
Smiles: CC1CCCCN1C(=O)C12CCC(C2(C)C)(C(=O)O1)C
STK967885
Synonyms: 3-(1H-benzimidazol-2-yl)-7-hydroxy-2-methyl-4H-chromen-4-one
Smiles: Oc1ccc2c(c1)oc(c(c2=O)c1nc2c([nH]1)cccc2)C
STK967886
Synonyms: 3-[3-(1H-benzimidazol-2-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromen-2-yl]propanoicacid
Smiles: CCc1cc2c(cc1O)oc(c(c2=O)c1nc2c([nH]1)cccc2)CCC(=O)O
STK967887
Synonyms: 3-[3-(1,3-benzothiazol-2-yl)-7-hydroxy-4-oxo-6-propyl-4H-chromen-2-yl]propanoicacid
Smiles: CCCc1cc2c(cc1O)oc(c(c2=O)c1nc2c(s1)cccc2)CCC(=O)O
STK967888
Synonyms: 3-(1,3-benzothiazol-2-yl)-7-hydroxy-8-methyl-6-(morpholin-4-ylmethyl)-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: Oc1c(CN2CCOCC2)cc2c(c1C)oc(c(c2=O)c1nc2c(s1)cccc2)C(F)(F)F
STK967889
Synonyms: 6-ethyl-7-hydroxy-2-methyl-3-(1-methyl-1H-benzimidazol-2-yl)-8-[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-one
Smiles: CCc1cc2c(c(c1O)CN1CCN(CC1)C)oc(c(c2=O)c1nc2c(n1C)cccc2)C
STK967890
Synonyms: 3-(1H-benzimidazol-2-yl)-7-hydroxy-8-[(3-methylpiperidin-1-yl)methyl]-2H-chromen-2-one
Smiles: CC1CCCN(C1)Cc1c(O)ccc2c1oc(=O)c(c2)c1nc2c([nH]1)cccc2
STK967891
Synonyms: 2-(1,3-benzothiazol-2-yl)-1-(5-ethyl-2,4-dihydroxyphenyl)ethanone
Smiles: CCc1cc(C(=O)Cc2nc3c(s2)cccc3)c(cc1O)O
STK967892
Synonyms: 4-[4-(1,3-benzothiazol-2-yl)-5-(trifluoromethyl)-1H-pyrazol-3-yl]benzene-1,3-diol
Smiles: Oc1ccc(c(c1)O)c1n[nH]c(c1c1nc2c(s1)cccc2)C(F)(F)F
STK967895
Synonyms: 3-(1,3-benzothiazol-2-yl)-7-hydroxy-2-methyl-8-[(3-methylpiperidin-1-yl)methyl]-4H-chromen-4-one
Smiles: CC1CCCN(C1)Cc1c(O)ccc2c1oc(C)c(c2=O)c1nc2c(s1)cccc2
STK967896
Synonyms: 7-hydroxy-3-(4-methyl-1,3-thiazol-2-yl)-8-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)methyl]-2H-chromen-2-one
Smiles: Cc1csc(n1)c1cc2ccc(c(c2oc1=O)CN1CC2(CC1CC(C2)(C)C)C)O
STK967897
Synonyms: 2-{[3-(ethoxycarbonyl)-1,2-dimethyl-1H-indol-5-yl]oxy}propanoicacid
Smiles: CCOC(=O)c1c(C)n(c2c1cc(cc2)OC(C(=O)O)C)C
STK967898
Synonyms: 8-[(dimethylamino)methyl]-6-ethyl-7-hydroxy-3-(1-methyl-1H-benzimidazol-2-yl)-4H-chromen-4-one
Smiles: CCc1cc2c(c(c1O)CN(C)C)occ(c2=O)c1nc2c(n1C)cccc2
STK967899
Synonyms: 8-[(3,3-dimethylpiperidin-1-yl)methyl]-6-ethyl-7-hydroxy-3-(1-methyl-1H-benzimidazol-2-yl)-4H-chromen-4-one
Smiles: CCc1cc2c(c(c1O)CN1CCCC(C1)(C)C)occ(c2=O)c1nc2c(n1C)cccc2
STK967900
Synonyms: 6-ethyl-7-hydroxy-3-(1-methyl-1H-benzimidazol-2-yl)-8-[(4-methylpiperidin-1-yl)methyl]-4H-chromen-4-one
Smiles: CCc1cc2c(c(c1O)CN1CCC(CC1)C)occ(c2=O)c1nc2c(n1C)cccc2
STK967901
Synonyms: 6-ethyl-7-hydroxy-3-(1-methyl-1H-benzimidazol-2-yl)-8-[(3-methylpiperidin-1-yl)methyl]-4H-chromen-4-one
Smiles: CCc1cc2c(c(c1O)CN1CCCC(C1)C)occ(c2=O)c1nc2c(n1C)cccc2
STK967902
Synonyms: 3-(1,3-benzothiazol-2-yl)-7-hydroxy-2-methyl-8-[(4-methylpiperazin-1-yl)methyl]-6-propyl-4H-chromen-4-one
Smiles: CCCc1cc2c(c(c1O)CN1CCN(CC1)C)oc(c(c2=O)c1nc2c(s1)cccc2)C
STK967903
Synonyms: 7-hydroxy-3-(1-methyl-1H-benzimidazol-2-yl)-8-[(4-methylpiperidin-1-yl)methyl]-2H-chromen-2-one
Smiles: CC1CCN(CC1)Cc1c(O)ccc2c1oc(=O)c(c2)c1nc2c(n1C)cccc2
STK967904
Synonyms: 7-hydroxy-3-(1-methyl-1H-benzimidazol-2-yl)-8-(pyrrolidin-1-ylmethyl)-2H-chromen-2-one
Smiles: Oc1ccc2c(c1CN1CCCC1)oc(=O)c(c2)c1nc2c(n1C)cccc2
STK967905
Synonyms: 6-ethyl-7-hydroxy-8-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-3-(1-methyl-1H-benzimidazol-2-yl)-4H-chromen-4-one
Smiles: OCCN1CCN(CC1)Cc1c(O)c(CC)cc2c1occ(c2=O)c1nc2c(n1C)cccc2
STK967906
Synonyms: 3,3'-methanediylbis(4-hydroxy-6-methylquinolin-2(1H)-one)
Smiles: Oc1c(Cc2c(=O)[nH]c3c(c2O)cc(cc3)C)c(=O)[nH]c2c1cc(C)cc2
STK967907
Synonyms: ethyl3-(1,3-benzothiazol-2-yl)-6-ethyl-7-hydroxy-4-oxo-8-(pyrrolidin-1-ylmethyl)-4H-chromene-2-carboxylate
Smiles: CCOC(=O)c1oc2c(CN3CCCC3)c(O)c(cc2c(=O)c1c1nc2c(s1)cccc2)CC
STK967908
Synonyms: 7-hydroxy-8-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-3-(quinolin-2-yl)-2H-chromen-2-one
Smiles: OCCN1CCN(CC1)Cc1c(O)ccc2c1oc(=O)c(c2)c1ccc2c(n1)cccc2
STK967911
Synonyms: 4-chloro-N-(6-chloro-1,3-benzothiazol-2-yl)-1-methyl-1H-pyrazole-5-carboxamide
Smiles: Clc1ccc2c(c1)sc(n2)NC(=O)c1c(Cl)cnn1C
STK967912
Synonyms: 5-[4-(benzyloxy)-2,3-dibromo-5-methoxybenzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: COc1cc(C=C2C(=O)NC(=S)NC2=O)c(c(c1OCc1ccccc1)Br)Br
STK967915
Synonyms: N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}-1-methyl-1H-pyrazole-5-carboxamide
Smiles: S=C(NC(=O)c1ccnn1C)Nc1cc(ccc1Cl)C(F)(F)F
STK967917
Synonyms: 2-(2-bromo-6-ethoxy-4-{(Z)-[1-(3-methylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}phenoxy)acetamide
Smiles: CCOc1cc(/C=C\2/C(=O)NC(=O)N(C2=O)c2cccc(c2)C)cc(c1OCC(=O)N)Br
STK967918
Synonyms: 1-ethyl-N-(4-sulfamoylbenzyl)-1H-pyrazole-5-carboxamide
Smiles: CCn1nccc1C(=O)NCc1ccc(cc1)S(=O)(=O)N
STK967922
Synonyms: N-[3-(morpholin-4-yl)propyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
Smiles: O1CCN(CC1)CCCNc1c2CCCc2nc2c1cccc2
STK967923
Synonyms: 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl5-bromopyridine-3-carboxylate
Smiles: COc1ccc(cc1)Oc1c(=O)c2ccc(cc2oc1C(F)(F)F)OC(=O)c1cncc(c1)Br
STK967924
Synonyms: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2,4,6-trimethylbenzamide
Smiles: N#Cc1c(NC(=O)c2c(C)cc(cc2C)C)sc2c1CCC(C2)C
STK967925
Synonyms: 4-[(2-methylcyclohexyl)amino]tetrahydrothiophene-3-ol1,1-dioxide
Smiles: CC1CCCCC1NC1CS(=O)(=O)CC1O
STK967926
Synonyms: ethyl6-chloro-4-(cyclohexylamino)-8-methylquinoline-3-carboxylate
Smiles: CCOC(=O)c1cnc2c(c1NC1CCCCC1)cc(cc2C)Cl
STK967927
Synonyms: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-6-methylpyrimidin-4(1H)-one
Smiles: Brc1ccc(cc1)C(=O)CSc1nc(=O)cc([nH]1)C
STK967928
Synonyms: 5-methyl-11H-isoquino[3,2-b]quinazoline-11,13(5H)-dione
Smiles: O=c1c2ccccc2cc2n1c(=O)c1ccccc1n2C
STK967933
Synonyms: 3-carbamoyl-1-[2-(2,4-dihydroxyphenyl)-2-oxoethyl]pyridinium
Smiles: Oc1ccc(c(c1)O)C(=O)C[n+]1cccc(c1)C(=O)N
STK967934
Synonyms: 3-(1-benzofuran-2-yl)-7-hydroxy-6-propyl-4H-chromen-4-one
Smiles: CCCc1cc2c(cc1O)occ(c2=O)c1cc2c(o1)cccc2
STK967935
Synonyms: 4-(2,3-dihydro-1,4-benzodioxin-6-ylacetyl)-3-hydroxyphenylhexopyranoside
Smiles: OCC1OC(Oc2ccc(c(c2)O)C(=O)Cc2ccc3c(c2)OCCO3)C(C(C1O)O)O
STK967936
Synonyms: 2-(2-methylphenyl)-2,3-dihydro-1H-isoindol-1-imine
Smiles: Cc1ccccc1N1Cc2c(C1=N)cccc2
STK967937
Synonyms: 1-[(4-methoxyphenyl)carbonyl]-N-phenyl-1H-benzimidazole-2-carboxamide
Smiles: COc1ccc(cc1)C(=O)n1c(nc2c1cccc2)C(=O)Nc1ccccc1
STK967939
Synonyms: 9-hydroxy-7-methyl-8-(morpholin-4-ylmethyl)-2,3-dihydrocyclopenta[c]chromen-4(1H)-one
Smiles: Cc1cc2oc(=O)c3c(c2c(c1CN1CCOCC1)O)CCC3
STK967940
Synonyms: 7-methoxy-2-methyl-3-phenyl-4H-chromen-4-one
Smiles: COc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C
STK967941
Synonyms: 2-[4-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]-5-methoxyphenol
Smiles: COc1ccc(c(c1)O)c1n[nH]c(c1c1ccc(cc1)F)C
STK967942
Synonyms: 2-(7-hydroxy-2-methyl-4-oxo-4H-chromen-3-yl)-1H-isoindole-1,3(2H)-dione
Smiles: Oc1ccc2c(c1)oc(c(c2=O)N1C(=O)c2c(C1=O)cccc2)C
STK967943
Synonyms: 7-hydroxy-3-(2-methylphenyl)-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: Oc1ccc2c(c1)oc(c(c2=O)c1ccccc1C)C(F)(F)F
STK967944
Synonyms: 7-ethoxy-8-methyl-3-phenyl-4H-chromen-4-one
Smiles: CCOc1ccc2c(c1C)occ(c2=O)c1ccccc1
STK967945
Synonyms: 7,8-dimethoxy-3-phenoxy-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: COc1c(OC)ccc2c1oc(c(c2=O)Oc1ccccc1)C(F)(F)F
STK967946
Synonyms: 2-[3-(3,4-dihydroquinolin-1(2H)-yl)-3-oxopropyl]-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: O=C(N1CCCc2c1cccc2)CCn1c(=O)c2cccc3c2c(c1=O)ccc3
STK967947
Synonyms: 1-[4-(2-fluorophenyl)piperazin-1-yl]-3-(3-methoxyphenoxy)propan-2-ol
Smiles: COc1cccc(c1)OCC(CN1CCN(CC1)c1ccccc1F)O
STK967948
Synonyms: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-(3-methoxyphenoxy)propan-2-ol
Smiles: COc1cccc(c1)OCC(CN1CCN(CC1)Cc1ccc2c(c1)OCO2)O
STK967949
Synonyms: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-(4-tert-butylphenoxy)propan-2-ol
Smiles: OC(CN1CCN(CC1)Cc1ccc2c(c1)OCO2)COc1ccc(cc1)C(C)(C)C
STK967950
Synonyms: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-(naphthalen-2-yloxy)propan-2-ol
Smiles: OC(CN1CCN(CC1)Cc1ccc2c(c1)OCO2)COc1ccc2c(c1)cccc2
STK967951
Synonyms: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-(4-propylphenoxy)propan-2-ol
Smiles: CCCc1ccc(cc1)OCC(CN1CCN(CC1)Cc1ccc2c(c1)OCO2)O
STK967952
Synonyms: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-(3,4-dimethylphenoxy)propan-2-ol
Smiles: OC(CN1CCN(CC1)Cc1ccc2c(c1)OCO2)COc1ccc(c(c1)C)C
STK967953
Synonyms: 2-[1-(4-methoxyphenyl)-3-oxo-3-phenylpropyl]cyclohexanone
Smiles: COc1ccc(cc1)C(C1CCCCC1=O)CC(=O)c1ccccc1
STK967954
Synonyms: 7-(3,4-dimethoxyphenyl)-6H,7H,8H-pyrano[3,2-c:5,6-c']dichromene-6,8-dione
Smiles: COc1cc(ccc1OC)C1c2c(=O)oc3c(c2Oc2c1c(=O)oc1c2cccc1)cccc3
STK967955
Synonyms: 7-(3-nitrophenyl)-6H,7H,8H-pyrano[3,2-c:5,6-c']dichromene-6,8-dione
Smiles: O=c1oc2ccccc2c2c1C(c1cccc(c1)[N+](=O)[O-])c1c(=O)oc3c(c1O2)cccc3
STK967956
Synonyms: (2-oxo-2H-benzo[h]chromen-4-yl)aceticacid
Smiles: OC(=O)Cc1cc(=O)oc2c1ccc1c2cccc1
STK967957
Synonyms: 1-(2,4-dihydroxyphenyl)-2-(4-propylphenoxy)ethanone
Smiles: CCCc1ccc(cc1)OCC(=O)c1ccc(cc1O)O
STK967958
Synonyms: 1-(2,4-dihydroxy-3-methylphenyl)-2-(4-propylphenoxy)ethanone
Smiles: CCCc1ccc(cc1)OCC(=O)c1ccc(c(c1O)C)O
STK967959
Synonyms: 7-hydroxy-8-methyl-3-phenoxy-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: Oc1ccc2c(c1C)oc(c(c2=O)Oc1ccccc1)C(F)(F)F
STK967960
Synonyms: 7,8-dihydroxy-2-methyl-3-phenoxy-4H-chromen-4-one
Smiles: Cc1oc2c(O)c(O)ccc2c(=O)c1Oc1ccccc1
STK967961
Synonyms: 7,8-dihydroxy-3-phenoxy-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: Oc1ccc2c(c1O)oc(c(c2=O)Oc1ccccc1)C(F)(F)F
STK967962
Synonyms: 2-methyl-4-(5-methyl-4-phenoxy-1H-pyrazol-3-yl)benzene-1,3-diol
Smiles: Oc1ccc(c(c1C)O)c1n[nH]c(c1Oc1ccccc1)C
STK967963
Synonyms: 5-methoxy-3-methyl-2-(5-methyl-4-phenoxy-1H-pyrazol-3-yl)phenol
Smiles: COc1cc(C)c(c(c1)O)c1n[nH]c(c1Oc1ccccc1)C
STK967964
Synonyms: 2-methyl-4-[4-(2-methylphenyl)-5-(trifluoromethyl)-1H-pyrazol-3-yl]benzene-1,3-diol
Smiles: Cc1c(O)ccc(c1O)c1n[nH]c(c1c1ccccc1C)C(F)(F)F
STK967965
Synonyms: 3-(4-fluorophenoxy)-2,8-dimethyl-4-oxo-4H-chromen-7-ylacetate
Smiles: CC(=O)Oc1ccc2c(c1C)oc(c(c2=O)Oc1ccc(cc1)F)C
STK967966
Synonyms: 3-(4-fluorophenoxy)-7-hydroxy-2,8-dimethyl-4H-chromen-4-one
Smiles: Fc1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2C)O
STK967967
Synonyms: 3-(2-fluorophenoxy)-7-methoxy-4H-chromen-4-one
Smiles: COc1ccc2c(c1)occ(c2=O)Oc1ccccc1F
STK967968
Synonyms: 2-[4-(2-fluorophenoxy)-1H-pyrazol-3-yl]-5-methoxyphenol
Smiles: COc1ccc(c(c1)O)c1n[nH]cc1Oc1ccccc1F
STK967969
Synonyms: 8-[(dimethylamino)methyl]-7-hydroxy-2-methyl-3-(1-phenyl-1H-pyrazol-4-yl)-4H-chromen-4-one
Smiles: CN(Cc1c(O)ccc2c1oc(C)c(c2=O)c1cnn(c1)c1ccccc1)C
STK967970
Synonyms: 8-[(dimethylamino)methyl]-7-hydroxy-3-(1-phenyl-1H-pyrazol-4-yl)-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: CN(Cc1c(O)ccc2c1oc(c(c2=O)c1cnn(c1)c1ccccc1)C(F)(F)F)C
STK967971
Synonyms: 7-hydroxy-8-methyl-3-(1-phenyl-1H-pyrazol-4-yl)-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: Oc1ccc2c(c1C)oc(c(c2=O)c1cnn(c1)c1ccccc1)C(F)(F)F
STK967972
Synonyms: 7-methoxy-8-methyl-3-(1-phenyl-1H-pyrazol-4-yl)-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: COc1ccc2c(c1C)oc(c(c2=O)c1cnn(c1)c1ccccc1)C(F)(F)F
STK967973
Synonyms: 6-[(dimethylamino)methyl]-7-hydroxy-8-methyl-3-(1-phenyl-1H-pyrazol-4-yl)-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: CN(Cc1cc2c(=O)c(c3cnn(c3)c3ccccc3)c(oc2c(c1O)C)C(F)(F)F)C
STK967974
Synonyms: 8-[(dimethylamino)methyl]-3-(4-fluorophenyl)-7-hydroxy-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: CN(Cc1c(O)ccc2c1oc(c(c2=O)c1ccc(cc1)F)C(F)(F)F)C
STK967975
Synonyms: 7,8-dimethoxy-3-(1-phenyl-1H-pyrazol-4-yl)-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: COc1c(OC)ccc2c1oc(c(c2=O)c1cnn(c1)c1ccccc1)C(F)(F)F
STK967976
Synonyms: 4-ethyl-2-[4-(4-fluorophenyl)-1H-pyrazol-3-yl]-5-methoxyphenol
Smiles: COc1cc(O)c(cc1CC)c1n[nH]cc1c1ccc(cc1)F
STK967977
Synonyms: 6-ethyl-3-(2-fluorophenoxy)-7-hydroxy-4H-chromen-4-one
Smiles: CCc1cc2c(cc1O)occ(c2=O)Oc1ccccc1F
STK967978
Synonyms: 2-[(3-benzyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetamide
Smiles: NC(=O)COc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1
STK967979
Synonyms: 4-ethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2H-chromen-2-one
Smiles: CCc1cc(=O)oc2c1ccc(c2)OCC=C(C)C
STK967983
Synonyms: 2-imino-8-methyl-3-[(4-methylphenyl)sulfonyl]-1-(pyridin-3-ylmethyl)-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Smiles: Cc1ccc(cc1)S(=O)(=O)c1cc2c(n(c1=N)Cc1cccnc1)nc1n(c2=O)cc(cc1)C
STK967984
Synonyms: 4-({2,5-dimethyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl}methyl)morpholine
Smiles: Cc1cc(c(n1c1cccc(c1)C(F)(F)F)C)CN1CCOCC1
STK967985
Synonyms: 7-[(2-chlorophenyl)(piperidin-1-yl)methyl]quinolin-8-ol
Smiles: Clc1ccccc1C(c1ccc2c(c1O)nccc2)N1CCCCC1
STK967986
Synonyms: 4-[2-(4-methylphenyl)-4-oxo-4,5,6,7-tetrahydro-1H-indol-1-yl]benzoicacid
Smiles: Cc1ccc(cc1)c1cc2c(n1c1ccc(cc1)C(=O)O)CCCC2=O
STK967987
Synonyms: 6-chloro-3-(furan-2-ylmethyl)-3,4-dihydro-2H-[1,3]oxazino[5,6-h]quinoline
Smiles: Clc1cc2CN(COc2c2c1cccn2)Cc1ccco1
STK967988
Synonyms: 6-chloro-3-(tetrahydrofuran-2-ylmethyl)-3,4-dihydro-2H-[1,3]oxazino[5,6-h]quinoline
Smiles: Clc1cc2CN(COc2c2c1cccn2)CC1CCCO1
STK967989
Synonyms: 6-chloro-3-(2,2,6,6-tetramethylpiperidin-4-yl)-3,4-dihydro-2H-[1,3]oxazino[5,6-h]quinoline
Smiles: Clc1cc2CN(COc2c2c1cccn2)C1CC(C)(C)NC(C1)(C)C
STK967990
Synonyms: 6-chloro-3-cyclohexyl-3,4-dihydro-2H-[1,3]oxazino[5,6-h]quinoline
Smiles: Clc1cc2CN(COc2c2c1cccn2)C1CCCCC1
STK967991
Synonyms: 3-benzyl-6-chloro-3,4-dihydro-2H-[1,3]oxazino[5,6-h]quinoline
Smiles: Clc1cc2CN(COc2c2c1cccn2)Cc1ccccc1
STK967992
Synonyms: 6-chloro-3-(1,1-dioxidotetrahydrothiophen-3-yl)-3,4-dihydro-2H-[1,3]oxazino[5,6-h]quinoline
Smiles: Clc1cc2CN(COc2c2c1cccn2)C1CCS(=O)(=O)C1
STK967993
Synonyms: 7-[(4-fluorophenyl)(piperidin-1-yl)methyl]quinolin-8-ol
Smiles: Fc1ccc(cc1)C(c1ccc2c(c1O)nccc2)N1CCCCC1
STK967994
Synonyms: 7-[(4-methoxyphenyl)(pyrrolidin-1-yl)methyl]quinolin-8-ol
Smiles: COc1ccc(cc1)C(c1ccc2c(c1O)nccc2)N1CCCC1
STK967995
Synonyms: 3,4,5-trimethoxy-N-[(2-methyl-1H-indol-5-yl)methyl]benzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)NCc1ccc2c(c1)cc([nH]2)C
STK967996
Synonyms: 3-{[4-(2-fluorophenyl)piperazin-1-yl](pyridin-2-yl)methyl}-2-methyl-1H-indole
Smiles: Fc1ccccc1N1CCN(CC1)C(c1c(C)[nH]c2c1cccc2)c1ccccn1
STK967997
Synonyms: 1-ethyl-6-[(4-methylpiperidin-1-yl)sulfonyl]benzo[cd]indol-2(1H)-one
Smiles: CCn1c2ccc(c3c2c(c1=O)ccc3)S(=O)(=O)N1CCC(CC1)C
STK967998
Synonyms: 5-chloroquinolin-8-yl2-fluorobenzoate
Smiles: O=C(c1ccccc1F)Oc1ccc(c2c1nccc2)Cl
STK967999
Synonyms: 1-(4-hydroxyphenyl)-2-phenyl-1,5,6,7-tetrahydro-4H-indol-4-one
Smiles: Oc1ccc(cc1)n1c(cc2c1CCCC2=O)c1ccccc1
STK968000
Synonyms: N-(2-{[1-(4-methoxyphenyl)-3-oxo-3-(thiophen-2-yl)propyl]sulfanyl}phenyl)acetamide
Smiles: COc1ccc(cc1)C(Sc1ccccc1NC(=O)C)CC(=O)c1cccs1
STK968001
Synonyms: 4-methoxy-N-[(2-methyl-1H-indol-5-yl)methyl]benzamide
Smiles: COc1ccc(cc1)C(=O)NCc1ccc2c(c1)cc([nH]2)C
STK968002
Synonyms: ethyl1-[(5-chloro-8-hydroxyquinolin-7-yl)methyl]piperidine-3-carboxylate
Smiles: CCOC(=O)C1CCCN(C1)Cc1cc(Cl)c2c(c1O)nccc2
STK968003
Synonyms: 5-chloro-7-[(2,6-dimethylmorpholin-4-yl)(pyridin-2-yl)methyl]quinolin-8-ol
Smiles: CC1OC(C)CN(C1)C(c1cc(Cl)c2c(c1O)nccc2)c1ccccn1
STK968004
Synonyms: 2,6-bis(piperidin-1-ylmethyl)cyclohexanone
Smiles: O=C1C(CCCC1CN1CCCCC1)CN1CCCCC1
STK968005
Synonyms: 4-({(Z)-[3-(ethoxycarbonyl)-2-methyl-5-oxonaphtho[1,2-b]furan-4(5H)-ylidene]methyl}amino)butanoicacid
Smiles: CCOC(=O)c1c(C)oc2c1/C(=C/NCCCC(=O)O)/C(=O)c1c2cccc1
STK968006
Synonyms: N'-(2,4-dihydroxybenzylidene)-3-hydroxy-4,7,7-trimethylbicyclo[2.2.1]heptane-1-carbohydrazide
Smiles: Oc1ccc(c(c1)O)/C=N\NC(=O)C12CCC(C2(C)C)(C(C1)O)C
STK968007
Synonyms: methyl2-bromo-2-(bromomethyl)-3,3-dimethylbicyclo[2.2.1]heptane-1-carboxylate
Smiles: COC(=O)C12CCC(C1)C(C2(Br)CBr)(C)C
STK968008
Synonyms: N-(2,4-dimethoxyphenyl)-N~2~-(2-methylpropyl)asparagine
Smiles: COc1cc(OC)ccc1NC(=O)CC(C(=O)O)NCC(C)C
STK968009
Synonyms: 2-benzyl-3-[(2,4-dichlorophenyl)sulfonyl]-5-(morpholin-4-yl)-1,2,4-thiadiazol-2-ium
Smiles: Clc1ccc(c(c1)Cl)S(=O)(=O)c1nc(s[n+]1Cc1ccccc1)N1CCOCC1
STK968010
Synonyms: 3-hydroxy-6-(hydroxymethyl)-2-{(2-hydroxyphenyl)[(4-methylpyridin-2-yl)amino]methyl}-4H-pyran-4-one
Smiles: OCc1cc(=O)c(c(o1)C(c1ccccc1O)Nc1nccc(c1)C)O
STK968011
Synonyms: 2-(3,4-dihydro-2H-pyrrol-5-ylamino)-1-phenylethanone
Smiles: O=C(c1ccccc1)CNC1=NCCC1
STK968013
Synonyms: 4-hydroxy-6-(3-methoxyphenyl)-5-(phenylcarbonyl)-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one
Smiles: COc1cccc(c1)C1NC(=O)NC(C1C(=O)c1ccccc1)(O)C(F)(F)F
STK968014
Synonyms: morpholin-4-yl[3-(4-nitrophenyl)tricyclo[3.3.1.1~3,7~]dec-1-yl]methanone
Smiles: O=C(C12CC3CC(C1)CC(C2)(C3)c1ccc(cc1)[N+](=O)[O-])N1CCOCC1
STK968015
Synonyms: 9-oxo-N-[4-(phenylamino)phenyl]bicyclo[3.3.1]nonane-3-carboxamide
Smiles: O=C(C1CC2CCCC(C1)C2=O)Nc1ccc(cc1)Nc1ccccc1
STK968016
Synonyms: propyl3-{[(9-oxobicyclo[3.3.1]non-3-yl)carbonyl]amino}benzoate
Smiles: CCCOC(=O)c1cccc(c1)NC(=O)C1CC2CCCC(C1)C2=O
STK968018
Synonyms: 2-[(4-chloro-2-oxo-2,3-dihydro-1,3-thiazol-5-yl)methylidene]-N-phenylhydrazinecarbothioamide
Smiles: S=C(Nc1ccccc1)N/N=C/c1sc(=O)[nH]c1Cl
STK968019
Synonyms: 4-[(2E)-2-(2-fluorobenzylidene)hydrazinyl]pyridine
Smiles: Fc1ccccc1/C=N/Nc1ccncc1
STK968020
Synonyms: 4-[(2E)-2-(naphthalen-1-ylmethylidene)hydrazinyl]pyridine
Smiles: n1ccc(cc1)N/N=C/c1cccc2c1cccc2
STK968021
Synonyms: 4-[(2E)-2-(2-chlorobenzylidene)hydrazinyl]pyridine
Smiles: Clc1ccccc1/C=N/Nc1ccncc1
STK968023
Synonyms: 2-{[5-(2-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1c1ccccc1)c1ccccc1Br)N/N=C/c1cn(nc1C)C
STK968024
Synonyms: 4-nitro-2-{(E)-[2-(pyridin-4-yl)hydrazinylidene]methyl}phenol
Smiles: Oc1ccc(cc1/C=N/Nc1ccncc1)[N+](=O)[O-]
STK968025
Synonyms: 4-[(2E)-2-(4-ethoxybenzylidene)hydrazinyl]pyridine
Smiles: CCOc1ccc(cc1)/C=N/Nc1ccncc1
STK968026
Synonyms: N-(4-oxo-2-thioxo-1,3-thiazolidin-3-yl)-2-(2,4,5-trichlorophenoxy)acetamide
Smiles: O=C(NN1C(=S)SCC1=O)COc1cc(Cl)c(cc1Cl)Cl
STK968027
Synonyms: 5-iodo-N-[(5-iodofuran-2-yl)carbonyl]-N-(3-methylpyridin-2-yl)furan-2-carboxamide
Smiles: Ic1ccc(o1)C(=O)N(c1ncccc1C)C(=O)c1ccc(o1)I
STK968028
Synonyms: N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2,2-diphenylhydrazinecarbothioamide
Smiles: S=C(Nc1c(=O)n(n(c1C)C)c1ccccc1)NN(c1ccccc1)c1ccccc1
STK968029
Synonyms: 4-(4-bromophenyl)-1-methyl-4,6,7,8-tetrahydroquinazoline-2,5(1H,3H)-dione
Smiles: Brc1ccc(cc1)C1NC(=O)N(C2=C1C(=O)CCC2)C
STK968030
Synonyms: 4-methyl-N-{4-methyl-5-[(phenylcarbamoyl)amino]-1,3-thiazol-2-yl}benzenesulfonamide
Smiles: O=C(Nc1sc(nc1C)NS(=O)(=O)c1ccc(cc1)C)Nc1ccccc1
STK968031
Synonyms: 2-(4-fluorophenoxy)-N'-[(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]acetohydrazide
Smiles: O=C(COc1ccc(cc1)F)NNC(=O)CSc1ncn[nH]1
STK968032
Synonyms: methyl(2'-oxo-2-phenyl-1,10b-dihydrospiro[pyrazolo[1,5-c][1,3]benzoxazine-5,4'-[1,3]thiazolidin]-5'-yl)acetate
Smiles: COC(=O)CC1SC(=O)NC21Oc1ccccc1C1N2N=C(C1)c1ccccc1
STK968033
Synonyms: N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-(4-phenoxyphenoxy)acetamide
Smiles: O=C(Nc1c(=O)n(n(c1C)C)c1ccccc1)COc1ccc(cc1)Oc1ccccc1
STK968034
Synonyms: (2Z)-2-(1,3-benzothiazol-2-yl)-3-hydroxy-3-(3,4,5-trimethoxyphenyl)prop-2-enenitrile
Smiles: N#C/C(=C(\c1cc(OC)c(c(c1)OC)OC)/O)/c1nc2c(s1)cccc2
STK968035
Synonyms: 1-(2,6-dimethylpiperidin-1-yl)-3-{[5-methyl-2-(propan-2-yl)cyclohexyl]oxy}propan-2-ol
Smiles: CC1CCC(C(C1)OCC(CN1C(C)CCCC1C)O)C(C)C
STK968036
Synonyms: 2-[(5E)-5-{[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-5-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]ethanesulfonicacid
Smiles: Brc1ccc(cc1)c1nn(c(c1)/C=C\1/SC(=S)N(C1=O)CCS(=O)(=O)O)c1ccccc1
STK968037
Synonyms: 5-amino-6-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-1-phenyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Smiles: Nn1c(SCc2ccc3c(c2)OCO3)nc2c(c1=O)cnn2c1ccccc1
STK968038
Synonyms: 6-[(E)-{(2E)-[5-(2-{[4-(ethoxycarbonyl)phenyl]amino}-2-oxoethyl)-4-oxo-1,3-thiazolidin-2-ylidene]hydrazinylidene}methyl]-2,3-dimethoxybenzoicacid
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CC1S/C(=N/N=C/c2ccc(c(c2C(=O)O)OC)OC)/NC1=O
STK968039
Synonyms: N-cyclohexyl-4-(4-methoxyphenyl)tetrahydro-2H-pyran-4-carboxamide
Smiles: COc1ccc(cc1)C1(CCOCC1)C(=O)NC1CCCCC1
STK968040
Synonyms: 7-[(4-ethylpiperazin-1-yl)(thiophen-2-yl)methyl]quinolin-8-ol
Smiles: CCN1CCN(CC1)C(c1ccc2c(c1O)nccc2)c1cccs1
STK968041
Synonyms: 1,3-benzodioxol-5-yl(isoquinolin-1-yl)methylfuran-2-carboxylate
Smiles: O=C(c1ccco1)OC(c1nccc2c1cccc2)c1ccc2c(c1)OCO2
STK968042
Synonyms: 5-[4-(benzyloxy)phenyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol
Smiles: C=CCn1c(S)nnc1c1ccc(cc1)OCc1ccccc1
STK968043
Synonyms: {[4-hydroxy-5-(4-methoxybenzyl)-6-methylpyrimidin-2-yl]sulfanyl}aceticacid
Smiles: COc1ccc(cc1)Cc1c(C)nc(nc1O)SCC(=O)O
STK968044
Synonyms: 5-(4-methoxybenzyl)-6-methyl-2-sulfanylpyrimidin-4-ol
Smiles: COc1ccc(cc1)Cc1c(C)nc(nc1O)S
STK968046
Synonyms: 1-{[5-(3-bromophenyl)-2-thioxo-1,3,4-oxadiazol-3(2H)-yl]methyl}pyrrolidin-2-one
Smiles: Brc1cccc(c1)c1nn(c(=S)o1)CN1CCCC1=O
STK968047
Synonyms: 2,2'-ethane-1,2-diylbis(4-methyl-1,3-thiazole)
Smiles: Cc1csc(n1)CCc1scc(n1)C
STK968048
Synonyms: 3-[(3-nitrophenyl)amino]isoquinolin-1(2H)-one
Smiles: [O-][N+](=O)c1cccc(c1)Nc1cc2ccccc2c(=O)[nH]1
STK968049
Synonyms: 5-ethyl-4-{[(1E,2Z)-3-phenylprop-2-en-1-ylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: CCc1nnc(n1/N=C/C=C\c1ccccc1)S
STK968050
Synonyms: ethyl4-{3-[2-(4-ethylphenoxy)ethoxy]-2-hydroxypropyl}piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)CC(COCCOc1ccc(cc1)CC)O
STK968051
Synonyms: N-(5-chloro-2-methoxyphenyl)-N~2~-(2-ethylhexyl)asparagine
Smiles: CCCCC(CNC(C(=O)O)CC(=O)Nc1cc(Cl)ccc1OC)CC
STK968052
Synonyms: 5-(3,4-diethoxyphenyl)-1-[2-(dimethylamino)ethyl]-4-(furan-2-ylcarbonyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1cc(ccc1OCC)C1N(CCN(C)C)C(=O)C(=C1C(=O)c1ccco1)O
STK968053
Synonyms: 5-[(E)-phenyldiazenyl]-4-thioxo-1,3-thiazolidin-2-one
Smiles: O=C1NC(=S)C(S1)/N=N/c1ccccc1
STK968055
Synonyms: 4-[(2Z)-3-benzyl-2-(phenylimino)-2,3-dihydro-1,3-thiazol-4-yl]benzene-1,2-diol
Smiles: Oc1cc(ccc1O)c1cs/c(=N\c2ccccc2)/n1Cc1ccccc1
STK968056
Synonyms: 4-[4-phenoxy-5-(trifluoromethyl)-1H-pyrazol-3-yl]benzene-1,3-diol
Smiles: Oc1ccc(c(c1)O)c1n[nH]c(c1Oc1ccccc1)C(F)(F)F
STK968057
Synonyms: 3-methoxy-2-methyl-6-[1'-phenyl-5-(trifluoromethyl)-1H,1'H-4,4'-bipyrazol-3-yl]phenol
Smiles: COc1ccc(c(c1C)O)c1n[nH]c(c1c1cnn(c1)c1ccccc1)C(F)(F)F
STK968058
Synonyms: 7-(1-phenyl-1H-pyrazol-4-yl)-6H-[1,3]dioxolo[4,5-h]chromen-6-one
Smiles: O=c1c(coc2c1ccc1c2OCO1)c1cnn(c1)c1ccccc1
STK968059
Synonyms: 5-(1'-phenyl-1H,1'H-4,4'-bipyrazol-3-yl)-1,3-benzodioxol-4-ol
Smiles: Oc1c(ccc2c1OCO2)c1n[nH]cc1c1cnn(c1)c1ccccc1
STK968060
Synonyms: 7,8-dihydroxy-2-methyl-3-(1-phenyl-1H-pyrazol-4-yl)-4H-chromen-4-one
Smiles: Cc1oc2c(O)c(O)ccc2c(=O)c1c1cnn(c1)c1ccccc1
STK968061
Synonyms: 3-(4-fluorophenyl)-7-hydroxy-2-methyl-4H-chromen-4-one
Smiles: Fc1ccc(cc1)c1c(C)oc2c(c1=O)ccc(c2)O
STK968062
Synonyms: (2E)-1-acetyl-5-bromo-2-(3-nitrobenzylidene)-1,2-dihydro-3H-indol-3-one
Smiles: Brc1ccc2c(c1)C(=O)/C(=C\c1cccc(c1)[N+](=O)[O-])/N2C(=O)C
STK968063
Synonyms: 9-(4-methoxyphenyl)-5H,8H-pyrrolo[3',4':4,5][1,3]thiazolo[3,2-a]quinazoline-5,8,10(9H)-trione
Smiles: COc1ccc(cc1)n1c(=O)c2c(c1=O)n1c(s2)nc(=O)c2c1cccc2
STK968064
Synonyms: benzyl4-(2-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: O=C1NC(=C(C(N1)c1c(Cl)nc2n(c1=O)cccc2)C(=O)OCc1ccccc1)C
STK968065
Synonyms: 4-[(4-chlorophenyl)carbonyl]-3-hydroxy-5-(3-nitrophenyl)-1-(pyridin-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Clc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1ccccn1
STK968066
Synonyms: ethyl1-cyanoisoquinoline-2(1H)-carboxylate
Smiles: CCOC(=O)N1C=Cc2c(C1C#N)cccc2
STK968067
Synonyms: 1-[4-(2-fluorophenyl)piperazin-1-yl]-3-(4-propylphenoxy)propan-2-ol
Smiles: CCCc1ccc(cc1)OCC(CN1CCN(CC1)c1ccccc1F)O
STK968068
Synonyms: 4-methyl-6-oxo-6H-benzo[c]chromen-3-ylN-[(benzyloxy)carbonyl]glycinate
Smiles: O=C(OCc1ccccc1)NCC(=O)Oc1ccc2c(c1C)oc(=O)c1c2cccc1
STK968069
Synonyms: {3-[2-(diethylamino)ethyl]-5,6-dimethyl-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl}(phenyl)methanone
Smiles: CCN(CCN1CN(C(=O)c2ccccc2)c2c(C1)c(C)c(s2)C)CC
STK968070
Synonyms: 4-tert-butyl-N-({5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}methyl)benzamide
Smiles: O=C(c1ccc(cc1)C(C)(C)C)NCc1nnc(s1)SCc1cccc2c1cccc2
STK968071
Synonyms: 3-[(Z)-(3-butyl-4-oxo-2-sulfanyl-1,3-thiazolidin-5-ylidene)methyl]-2-(4-tert-butylphenoxy)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCCCN1C(S)S/C(=C\c2c(Oc3ccc(cc3)C(C)(C)C)nc3n(c2=O)cccc3)/C1=O
STK968072
Synonyms: 1-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(furan-2-ylmethyl)urea
Smiles: N#Cc1c(NC(=O)NCc2ccco2)sc2c1CCC2
STK968073
Synonyms: 6-(4-chloro-3-nitrophenyl)-3-(pyridin-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: [O-][N+](=O)c1cc(ccc1Cl)c1nn2c(s1)nnc2c1ccncc1
STK968074
Synonyms: 2-tert-butyl-5-[(4-methylbenzyl)amino]-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1NCc1ccc(cc1)C)C(C)(C)C
STK968075
Synonyms: 9-methyl-4-oxo-2-[(1R,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]-4H-pyrido[1,2-a]pyrimidine-3-carbaldehyde
Smiles: O=Cc1c(nc2n(c1=O)cccc2C)N1C[C@@H]2C[C@H](C1)c1n(C2)c(=O)ccc1
STK968076
Synonyms: 6,8-dibromo-2-[4-(pyrrolidin-1-ylsulfonyl)phenyl]imidazo[1,2-a]pyridine
Smiles: Brc1cc(Br)cn2c1nc(c2)c1ccc(cc1)S(=O)(=O)N1CCCC1
STK968077
Synonyms: 4-benzyl-1-{[3-(2-methyl-1,3-thiazol-4-yl)phenyl]sulfonyl}piperidine
Smiles: Cc1scc(n1)c1cccc(c1)S(=O)(=O)N1CCC(CC1)Cc1ccccc1
STK968078
Synonyms: N-[4-({4-[(6-methoxy-2-oxo-2H-chromen-3-yl)carbonyl]piperazin-1-yl}sulfonyl)phenyl]acetamide
Smiles: COc1ccc2c(c1)cc(c(=O)o2)C(=O)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)NC(=O)C
STK968079
Synonyms: (2Z)-8-methoxy-2-(phenylimino)-2H-chromene-3-carboxamide
Smiles: COc1cccc2c1o/c(=N\c1ccccc1)/c(c2)C(=O)N
STK968080
Synonyms: 5-bromo-3-(6,6-dimethyl-4-oxotetrahydro-2H-pyran-3-yl)-1-ethyl-3-hydroxy-1,3-dihydro-2H-indol-2-one
Smiles: CCN1c2ccc(cc2C(C1=O)(O)C1COC(CC1=O)(C)C)Br
STK968081
Synonyms: 3,5-diethyl-2-hydrazinyl-5-methyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Smiles: CCC1(C)Cc2ccccc2c2c1c(=O)n(c(n2)NN)CC
STK968082
Synonyms: 3-[2-(benzyloxy)phenyl]-1-(2-methylphenyl)-5-oxopyrrolidine-2-carbonitrile
Smiles: N#CC1C(CC(=O)N1c1ccccc1C)c1ccccc1OCc1ccccc1
STK968083
Synonyms: N-(furan-2-ylmethyl)-2-(naphtho[2,1-b]furan-1-yl)acetamide
Smiles: O=C(Cc1coc2c1c1ccccc1cc2)NCc1ccco1
STK968084
Synonyms: N-(4-methoxyphenyl)-2-{4-oxo-2-[(4-sulfamoylphenyl)amino]-4,5-dihydro-1,3-thiazol-5-yl}acetamide
Smiles: COc1ccc(cc1)NC(=O)CC1SC(=NC1=O)Nc1ccc(cc1)S(=O)(=O)N
STK968085
Synonyms: (5Z)-5-(4-chlorobenzylidene)-2-(3,4-dimethoxyphenyl)-1,3-thiazolidin-4-one
Smiles: COc1cc(ccc1OC)C1NC(=O)/C(=C/c2ccc(cc2)Cl)/S1
STK968086
Synonyms: 2-(3-chloro-4-ethoxybenzyl)-4,5-dihydro-1H-imidazole
Smiles: CCOc1ccc(cc1Cl)CC1=NCCN1
STK968087
Synonyms: 5-methyl-3-(trifluoromethyl)-1H-1,2,4-triazole
Smiles: Cc1[nH]nc(n1)C(F)(F)F
STK968088
Synonyms: (2E)-2-cyano-2-[2-(3,4-dichlorophenyl)hydrazinylidene]-N-(tetrahydrofuran-2-ylmethyl)ethanamide
Smiles: N#C/C(=N\Nc1ccc(c(c1)Cl)Cl)/C(=O)NCC1CCCO1
STK968089
Synonyms: 6-{(E)-2-[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]ethenyl}-3-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: Cc1ccc(cc1)c1nnc2n1nc(s2)/C=C/c1cn(nc1c1ccc(cc1)F)c1ccccc1
STK968090
Synonyms: 1-[(3-nitrophenyl)sulfonyl]-2-(prop-2-en-1-ylsulfanyl)-1H-benzimidazole
Smiles: C=CCSc1nc2c(n1S(=O)(=O)c1cccc(c1)[N+](=O)[O-])cccc2
STK968091
Synonyms: (5Z)-5-[(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-3-(3-methoxypropyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COCCCN1C(=S)S/C(=C\c2c(C)nn(c2O)c2ccccc2)/C1=O
STK968092
Synonyms: 4-{(2Z)-2-[4,4,4-trifluoro-1-(4-fluorophenyl)-1,3-dioxobutan-2-ylidene]hydrazinyl}benzenesulfonamide
Smiles: Fc1ccc(cc1)C(=O)/C(=N/Nc1ccc(cc1)S(=O)(=O)N)/C(=O)C(F)(F)F
STK968093
Synonyms: 4-chloro-N-{2-[(1E)-1-cyano-3-phenylbut-1-en-1-yl]-4-(thiophen-2-yl)-1,3-thiazol-5-yl}benzamide
Smiles: N#C/C(=C\C(c1ccccc1)C)/c1sc(c(n1)c1cccs1)NC(=O)c1ccc(cc1)Cl
STK968094
Synonyms: N-(4-ethoxyphenyl)-2-methoxy-5-[1-(propan-2-yl)-1H-tetrazol-5-yl]benzenesulfonamide
Smiles: CCOc1ccc(cc1)NS(=O)(=O)c1cc(ccc1OC)c1nnnn1C(C)C
STK968095
Synonyms: 4-chloro-N-[(1E)-3-[(3-methoxypropyl)amino]-1-(2-methyl-2H-chromen-3-yl)-3-oxoprop-1-en-2-yl]benzamide
Smiles: COCCCNC(=O)/C(=C\C1=Cc2ccccc2OC1C)/NC(=O)c1ccc(cc1)Cl
STK968096
Synonyms: (2Z)-3-[5-(4-chlorophenyl)furan-2-yl]-N-(furan-2-ylmethyl)-2-(phenylsulfonyl)prop-2-enamide
Smiles: Clc1ccc(cc1)c1ccc(o1)/C=C(\S(=O)(=O)c1ccccc1)/C(=O)NCc1ccco1
STK968097
Synonyms: (5Z)-2-(3-methyl-1-benzofuran-2-yl)-5-(4-methylbenzylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Smiles: Cc1ccc(cc1)/C=c/1\sc2n(c1=O)nc(n2)c1oc2c(c1C)cccc2
STK968098
Synonyms: N-[4-cyano-2-(4-methylphenyl)-1,3-oxazol-5-yl]-4-methylbenzohydrazide
Smiles: N#Cc1nc(oc1N(C(=O)c1ccc(cc1)C)N)c1ccc(cc1)C
STK968099
Synonyms: methyl5-{2-[(4-methylphenyl)carbonyl]hydrazinyl}-2-phenyl-1,3-oxazole-4-carboxylate
Smiles: COC(=O)c1nc(oc1NNC(=O)c1ccc(cc1)C)c1ccccc1
STK968100
Synonyms: N-(3-chlorophenyl)-2-{1-[(3-nitrophenyl)carbonyl]-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl}acetamide
Smiles: O=C(CC1C(=O)Nc2c(N1C(=O)c1cccc(c1)[N+](=O)[O-])cccc2)Nc1cccc(c1)Cl
STK968101
Synonyms: (5Z)-3-(4-ethoxyphenyl)-5-[(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCOc1ccc(cc1)N1C(=S)S/C(=C\C2C(=NN(C2=O)c2ccccc2)C)/C1=O
STK968102
Synonyms: 4-fluoro-N-[(2Z)-4-(4-fluorophenyl)-3-(2-phenylethyl)-2-(phenylimino)-2,3-dihydro-1,3-thiazol-5-yl]benzamide
Smiles: Fc1ccc(cc1)c1c(NC(=O)c2ccc(cc2)F)s/c(=N\c2ccccc2)/n1CCc1ccccc1
STK968103
Synonyms: [(5E)-4-oxo-5-(1H-pyrrol-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl](phenyl)aceticacid
Smiles: OC(=O)C(N1C(=S)S/C(=C/c2ccc[nH]2)/C1=O)c1ccccc1
STK968104
Synonyms: N-(1,3-benzothiazol-2-yl)-4-hydroxy-3,6,6-trimethyl-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide
Smiles: O=C(c1oc2c(c1C)C(O)CC(C2)(C)C)Nc1nc2c(s1)cccc2
STK968105
Synonyms: N-(5-nitro-1,3-thiazol-2-yl)-2-oxo-2H-chromene-3-carboxamide
Smiles: O=C(c1cc2ccccc2oc1=O)Nc1ncc(s1)[N+](=O)[O-]
STK968106
Synonyms: 3-[(4-methylquinolin-2-yl)sulfanyl]propanehydrazide
Smiles: NNC(=O)CCSc1cc(C)c2c(n1)cccc2
STK968107
Synonyms: 3-[3-(3-oxo-6-phenyl-2,3,4,5-tetrahydropyridazin-4-yl)-1H-indol-1-yl]propanenitrile
Smiles: N#CCCn1cc(c2c1cccc2)C1CC(=NNC1=O)c1ccccc1
STK968109
Synonyms: 2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]-5-nitrobenzoicacid
Smiles: N#Cc1c(NC(=O)c2ccc(cc2C(=O)O)[N+](=O)[O-])sc2c1CCCC2
STK968120
Synonyms: N-{2-[(4-chlorophenyl)sulfanyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl}benzamide
Smiles: Clc1ccc(cc1)Sc1nn2c(c1NC(=O)c1ccccc1)nc(cc2C)C
STK968123
Synonyms: 2-(2,3-dihydro-1,4-benzodioxin-2-yl)-5-[(3,4-dimethoxybenzyl)sulfanyl]-1,3,4-thiadiazole
Smiles: COc1cc(CSc2nnc(s2)C2COc3c(O2)cccc3)ccc1OC
STK968124
Synonyms: 3,5,5-triethyl-5,6-dihydrobenzo[h]quinazoline-2,4(1H,3H)-dione
Smiles: CCn1c(=O)[nH]c2c(c1=O)C(CC)(CC)Cc1c2cccc1
STK968125
Synonyms: 5-(2-methoxynaphthalen-1-yl)-7-phenyl-5,8-dihydropyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione
Smiles: COc1ccc2c(c1C1C=C(Nc3c1c(=O)[nH]c(=O)[nH]3)c1ccccc1)cccc2
STK968126
Synonyms: (5-bromo-2-hydroxyphenyl)[5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone
Smiles: Brc1ccc(c(c1)C(=O)N1N=C(CC1(O)C(F)F)C)O
STK968128
Synonyms: 4-bromo-N-cycloheptyl-1-methyl-1H-pyrazole-3-carboxamide
Smiles: O=C(c1nn(cc1Br)C)NC1CCCCCC1
STK968129
Synonyms: 5-(4-bromophenyl)-3-chloro-N-(1-phenylethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: Brc1ccc(cc1)C1CC(n2c(N1)c(Cl)c(n2)C(=O)NC(c1ccccc1)C)C(F)(F)F
STK968130
Synonyms: (2E)-1-(3,4-dimethoxyphenyl)-3-(5-nitrothiophen-2-yl)prop-2-en-1-one
Smiles: COc1cc(ccc1OC)C(=O)/C=C/c1ccc(s1)[N+](=O)[O-]
STK968131
Synonyms: 2-(4-methylphenyl)-5-[(pyridin-3-ylmethyl)amino]-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1NCc1cccnc1)c1ccc(cc1)C
STK968135
Synonyms: N,N-bis(cyanomethyl)-2-(naphtho[2,1-b]furan-1-yl)acetamide
Smiles: N#CCN(C(=O)Cc1coc2c1c1ccccc1cc2)CC#N
STK968136
Synonyms: [4-hydroxy-6-(5-methylfuran-2-yl)-2-thioxo-4-(trifluoromethyl)hexahydropyrimidin-5-yl](phenyl)methanone
Smiles: S=C1NC(c2ccc(o2)C)C(C(N1)(O)C(F)(F)F)C(=O)c1ccccc1
STK968137
Synonyms: 3-[(4-benzylpiperazin-1-yl)(3,4,5-trimethoxyphenyl)methyl]-2-methyl-1H-indole
Smiles: COc1cc(cc(c1OC)OC)C(c1c(C)[nH]c2c1cccc2)N1CCN(CC1)Cc1ccccc1
STK968138
Synonyms: 1-[3-(cyclohexyloxy)-2-hydroxypropyl]-4-(phenylcarbonyl)piperazin-1-ium
Smiles: OC(C[NH+]1CCN(CC1)C(=O)c1ccccc1)COC1CCCCC1
STK968139
Synonyms: 4-[(2,3-dichlorophenyl)amino]tetrahydrothiophene-3-ol1,1-dioxide
Smiles: OC1CS(=O)(=O)CC1Nc1cccc(c1Cl)Cl
STK968141
Synonyms: 4-bromo-N-(4-carbamoylphenyl)-1-methyl-1H-pyrazole-3-carboxamide
Smiles: Cn1cc(c(n1)C(=O)Nc1ccc(cc1)C(=O)N)Br
STK968144
Synonyms: 2-(2,4-dichlorophenoxy)-1-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethanone
Smiles: Clc1ccc(c(c1)Cl)OCC(=O)n1nc(cc1C)C(F)(F)F
STK968145
Synonyms: 3-amino-N-(3-chloro-4-fluorophenyl)-6-(difluoromethyl)-4-methylthieno[2,3-b]pyridine-2-carboxamide
Smiles: O=C(c1sc2c(c1N)c(C)cc(n2)C(F)F)Nc1ccc(c(c1)Cl)F
STK968149
Synonyms: 4-bromo-N-(1H-indol-2-ylmethyl)-1-methyl-1H-pyrazole-3-carboxamide
Smiles: Cn1cc(c(n1)C(=O)NCc1cc2c([nH]1)cccc2)Br
STK968150
Synonyms: 2-(5-chlorothiophen-2-yl)-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]quinoline-4-carboxamide
Smiles: CCSc1nnc(s1)NC(=O)c1cc(nc2c1cccc2)c1ccc(s1)Cl
STK968151
Synonyms: 2,2,2-trifluoro-N-[(2,4,6-trimethylphenyl)carbamoyl]acetamide
Smiles: O=C(Nc1c(C)cc(cc1C)C)NC(=O)C(F)(F)F
STK968152
Synonyms: ethyl4-{[4-(acetylamino)phenyl]amino}-8-ethylquinoline-3-carboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccc(cc1)NC(=O)C)cccc2CC
STK968154
Synonyms: (2E)-2-cyano-N-ethyl-3-[4-oxo-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide
Smiles: CCNC(=O)/C(=C/c1c(nc2n(c1=O)cccc2)N1CCCCC1)/C#N
STK968157
Synonyms: ethyl4-{4-[(3-fluorobenzyl)oxy]-3-nitrophenyl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)[N+](=O)[O-])OCc1cccc(c1)F)C(=O)CC(C2)(C)C
STK968158
Synonyms: 2-methyl-4-oxo-3-phenoxy-4H-chromen-7-ylN-[(benzyloxy)carbonyl]glycinate
Smiles: O=C(OCc1ccccc1)NCC(=O)Oc1ccc2c(c1)oc(c(c2=O)Oc1ccccc1)C
STK968159
Synonyms: 2-oxo-2H-chromen-7-ylN-[(benzyloxy)carbonyl]glycinate
Smiles: O=C(Oc1ccc2c(c1)oc(=O)cc2)CNC(=O)OCc1ccccc1
STK968160
Synonyms: N-(4-bromophenyl)-4,7,7-trimethyl-2,3-dioxobicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1=O)C)Nc1ccc(cc1)Br
STK968161
Synonyms: 2-(4-methylpiperazin-1-yl)-4-[(3-nitrophenyl)amino]-4-oxobutanoicacid
Smiles: CN1CCN(CC1)C(C(=O)O)CC(=O)Nc1cccc(c1)[N+](=O)[O-]
STK968162
Synonyms: 2-(3-bromophenyl)-3-[2-(morpholin-4-yl)ethyl]-1,3-thiazolidin-4-one
Smiles: Brc1cccc(c1)C1SCC(=O)N1CCN1CCOCC1
STK968163
Synonyms: 2-(3,4-dimethoxyphenyl)-N-(1H-tetrazol-5-yl)quinoline-4-carboxamide
Smiles: COc1cc(ccc1OC)c1nc2ccccc2c(c1)C(=O)Nc1nnn[nH]1
STK968166
Synonyms: N-(4-methylphenyl)-3-(4-nitrophenyl)tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Smiles: Cc1ccc(cc1)NC(=O)C12CC3CC(C1)CC(C2)(C3)c1ccc(cc1)[N+](=O)[O-]
STK968167
Synonyms: 2-(9H-carbazol-9-yl)-N'-{(E)-[4-(trifluoromethyl)phenyl]methylidene}acetohydrazide
Smiles: O=C(Cn1c2ccccc2c2c1cccc2)N/N=C/c1ccc(cc1)C(F)(F)F
STK968168
Synonyms: 2-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(2-ethylphenyl)acetamide
Smiles: CCc1ccccc1NC(=O)CC1CCS(=O)(=O)C1
STK968173
Synonyms: 6-(difluoromethyl)-4-phenyl-2-thioxo-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(=S)[nH]c(cc1c1ccccc1)C(F)F
STK968175
Synonyms: 3-{(4E)-4-[4-(acetyloxy)-2-bromo-5-methoxybenzylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoicacid
Smiles: COc1cc(/C=C/2\C(=NN(C2=O)c2cccc(c2)C(=O)O)C)c(cc1OC(=O)C)Br
STK968177
Synonyms: 6-tert-butyl-8-{[(E)-(2-hydroxynaphthalen-1-yl)methylidene]amino}-3-thioxo-2,8-dihydro[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(3H)-one
Smiles: Oc1ccc2c(c1/C=N/n1c(=O)c(nn3c1n[nH]c3=S)C(C)(C)C)cccc2
STK968178
Synonyms: methyl(2E)-7-methyl-2-(3-nitrobenzylidene)-3-oxo-5-[4-(propan-2-yl)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)/c(=C\c1cccc(c1)[N+](=O)[O-])/s2
STK968179
Synonyms: 2-(2-chlorophenyl)-1H-pyrrolo[3',4':4,5][1,3]thiazolo[3,2-a]benzimidazole-1,3(2H)-dione
Smiles: O=c1c2sc3n(c2c(=O)n1c1ccccc1Cl)c1c(n3)cccc1
STK968181
Synonyms: ethyl(4-{(Z)-[1-(2-cyanoethyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenoxy)acetate
Smiles: CCOc1cc(ccc1OCC(=O)OCC)/C=C\1/C(=NN(C1=O)CCC#N)C
STK968182
Synonyms: (2E)-N-(2-methoxybenzyl)-3-(5-nitrofuran-2-yl)prop-2-enamide
Smiles: COc1ccccc1CNC(=O)/C=C/c1ccc(o1)[N+](=O)[O-]
STK968185
Synonyms: N-(6-bromoquinazolin-4-yl)-N'-phenylbenzene-1,4-diamine
Smiles: Brc1ccc2c(c1)c(ncn2)Nc1ccc(cc1)Nc1ccccc1
STK968186
Synonyms: 2-{[2-hydroxy-3-(3-methylphenoxy)propyl]amino}-2-methylpropan-1-ol
Smiles: OCC(NCC(COc1cccc(c1)C)O)(C)C
STK968192
Synonyms: 2,6-dimethyl-3-[(2-methylpiperidin-1-yl)methyl]quinolin-4-ol
Smiles: Cc1ccc2c(c1)c(O)c(c(n2)C)CN1CCCCC1C
STK968193
Synonyms: 3-(2-bromophenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-ylbutanoate
Smiles: CCCC(=O)Oc1ccc2c(c1)oc(c(c2=O)Oc1ccccc1Br)C(F)(F)F
STK968194
Synonyms: 9-pentofuranosyl-8-(piperidin-1-yl)-9H-purin-6-amine
Smiles: OCC1OC(C(C1O)O)n1c(nc2c1ncnc2N)N1CCCCC1
STK968195
Synonyms: propan-2-ylN-(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-beta-alaninate
Smiles: CC(OC(=O)CCNc1n[nH]c(=O)[nH]c1=O)C
STK968196
Synonyms: 2-(4-chlorophenyl)-4-(2,6-dimethylmorpholin-4-yl)quinazoline
Smiles: CC1OC(C)CN(C1)c1nc(nc2c1cccc2)c1ccc(cc1)Cl
STK968197
Synonyms: 4-{3-amino-2-[(4-methoxyphenyl)carbonyl]-4-(trifluoromethyl)thieno[2,3-b]pyridin-6-yl}-N,N-dimethylbenzenesulfonamide
Smiles: COc1ccc(cc1)C(=O)c1sc2c(c1N)c(cc(n2)c1ccc(cc1)S(=O)(=O)N(C)C)C(F)(F)F
STK968198
Synonyms: N-(5-bromopyridin-2-yl)-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide
Smiles: Brc1ccc(nc1)NC(=O)C12CCC(C2(C)C)(C(=O)C1)C
STK968199
Synonyms: 3a,6a-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)hexahydro-1H-1,4-methanocyclopenta[c]furan-1-carboxamide
Smiles: O=C(C12OCC3(C2(C)CCC3C1)C)NC1CC(C)(C)NC(C1)(C)C
STK968200
Synonyms: ethyl4-cyano-5-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-3-methylthiophene-2-carboxylate
Smiles: CCOC(=O)c1sc(c(c1C)C#N)N1C(=O)C2C(C1=O)C1OC2CC1
STK968201
Synonyms: 3-({2-[2-(2,5-dichlorophenoxy)butanoyl]hydrazinyl}carbonyl)bicyclo[2.2.1]heptane-2-carboxylicacid
Smiles: CCC(C(=O)NNC(=O)C1C2CCC(C1C(=O)O)C2)Oc1cc(Cl)ccc1Cl
STK968202
Synonyms: N-[5-(cyclopentylmethyl)-1,3,4-thiadiazol-2-yl]-3-methylbutanamide
Smiles: CC(CC(=O)Nc1nnc(s1)CC1CCCC1)C
STK968206
Synonyms: 2-{[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]carbamoyl}cyclohexanecarboxylicacid
Smiles: O=C(C1CCCCC1C(=O)O)Nc1sc(c(n1)c1ccc(cc1)Cl)C
STK968211
Synonyms: 2-(1,3-benzothiazol-2-yl)-4-[(E)-(cyclopentylimino)methyl]-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: O=C1N(N=C(C1/C=N/C1CCCC1)C(F)(F)F)c1nc2c(s1)cccc2
STK968212
Synonyms: 4-methoxy-N'-[(2E)-1-(5-nitro-2H-tetrazol-2-yl)propan-2-ylidene]benzohydrazide
Smiles: COc1ccc(cc1)C(=O)N/N=C(/Cn1nnc(n1)[N+](=O)[O-])\C
STK968219
Synonyms: 2,2',2''-[(2,4,6-trimethylbenzene-1,3,5-triyl)tris(methanediylsulfanediyl)]tris(1-methyl-1H-imidazole)
Smiles: Cc1c(CSc2nccn2C)c(C)c(c(c1CSc1nccn1C)C)CSc1nccn1C
STK968220
Synonyms: methyl5-(diethylcarbamoyl)-4-methyl-2-{[(1-oxo-1H-isochromen-3-yl)carbonyl]amino}thiophene-3-carboxylate
Smiles: CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=O)c1cc2ccccc2c(=O)o1)CC
STK968221
Synonyms: 2-(piperidin-1-yl)ethyl5-[(2-bromophenoxy)methyl]furan-2-carboxylate
Smiles: O=C(c1ccc(o1)COc1ccccc1Br)OCCN1CCCCC1
STK968222
Synonyms: (4-{(Z)-[1-(2-cyanoethyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenoxy)aceticacid
Smiles: CCOc1cc(ccc1OCC(=O)O)/C=C\1/C(=NN(C1=O)CCC#N)C
STK968223
Synonyms: ethyl(5-bromo-2-ethoxy-4-{(E)-[(2Z)-2-(naphthalen-1-ylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetate
Smiles: CCOc1cc(/C=C\2/S/C(=N\c3cccc4c3cccc4)/NC2=O)c(cc1OCC(=O)OCC)Br
STK968224
Synonyms: (5E)-5-(2-bromo-4-butoxy-5-methoxybenzylidene)-1-phenylimidazolidine-2,4-dione
Smiles: CCCCOc1cc(Br)c(cc1OC)/C=C/1\C(=O)NC(=O)N1c1ccccc1
STK968225
Synonyms: N-({5-[(3-bromobenzyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}methyl)-4-methylaniline
Smiles: C=CCn1c(nnc1SCc1cccc(c1)Br)CNc1ccc(cc1)C
STK968226
Synonyms: 4-[(2E)-2-(3-hydroxybenzylidene)hydrazinyl]-4-oxo-N-[4-(trifluoromethyl)phenyl]butanamide
Smiles: O=C(CCC(=O)Nc1ccc(cc1)C(F)(F)F)N/N=C/c1cccc(c1)O
STK968229
Synonyms: 5-(4-bromophenyl)-N-(thiophen-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: Brc1ccc(cc1)C1Nc2cc(nn2C(C1)C(F)(F)F)C(=O)NCc1cccs1
STK968231
Synonyms: 1-ethyl-2-{[2-(2-fluorophenoxy)ethyl]sulfanyl}-1H-benzimidazole
Smiles: CCn1c(SCCOc2ccccc2F)nc2c1cccc2
STK968233
Synonyms: 1-ethyl-N-(3-methoxyphenyl)-1H-pyrazole-5-carboxamide
Smiles: COc1cccc(c1)NC(=O)c1ccnn1CC
STK968234
Synonyms: 9-(2-bromo-5-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione
Smiles: COc1ccc(c(c1)C1C2=C(NC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(C)C)Br
STK968235
Synonyms: 1-(3-chlorophenyl)-3-(3-cyano-5-methyl-4-phenylthiophen-2-yl)urea
Smiles: N#Cc1c(NC(=O)Nc2cccc(c2)Cl)sc(c1c1ccccc1)C
STK968236
Synonyms: 4-bromo-N-cyclooctyl-1-methyl-1H-pyrazole-3-carboxamide
Smiles: O=C(c1nn(cc1Br)C)NC1CCCCCCC1
STK968238
Synonyms: (2Z)-2-(furan-3-ylmethylidene)-5-methyl-N-(2-methylphenyl)-1-oxo-1,2-dihydro-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocine-13-carboxamide
Smiles: O=C(C1C2c3ccccc3OC1(C)N=c1n2c(=O)/c(=C/c2ccoc2)/s1)Nc1ccccc1C
STK968241
Synonyms: 2,6,8-trimethyl-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)methyl]quinolin-4-ol
Smiles: Cc1cc(C)c2c(c1)c(O)c(c(n2)C)CN1CC2(CC1CC(C2)(C)C)C
STK968242
Synonyms: N'-[(3,5-dimethylphenoxy)acetyl]-N-propanoylpropanehydrazide
Smiles: CCC(=O)N(C(=O)CC)NC(=O)COc1cc(C)cc(c1)C
STK968243
Synonyms: 1-{3-[(4-hydroxy-1,1-dioxidotetrahydrothiophen-3-yl)amino]phenyl}ethanone
Smiles: OC1CS(=O)(=O)CC1Nc1cccc(c1)C(=O)C
STK968244
Synonyms: 4-[cyclohexyl(methyl)amino]-3-oxo-2-phenylbutanenitrile
Smiles: CN(C1CCCCC1)CC(=O)C(c1ccccc1)C#N
STK968245
Synonyms: 2-(2-fluorophenyl)-1-(2,4,6-trihydroxyphenyl)ethanone
Smiles: Oc1cc(O)c(c(c1)O)C(=O)Cc1ccccc1F
STK968246
Synonyms: 4-oxo-3-(1,3-thiazol-4-yl)-4H-chromen-7-ylformate
Smiles: O=COc1ccc2c(c1)occ(c2=O)c1cscn1
STK968247
Synonyms: 2-(2,4-difluorophenyl)-2,3-dihydro-1H-isoindol-1-imine
Smiles: Fc1ccc(c(c1)F)N1Cc2c(C1=N)cccc2
STK968248
Synonyms: 2-[3,5-bis(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindol-1-imine
Smiles: N=C1N(Cc2c1cccc2)c1cc(cc(c1)C(F)(F)F)C(F)(F)F
STK968249
Synonyms: 2-(4-ethoxyphenyl)-2,3-dihydro-1H-isoindol-1-imine
Smiles: CCOc1ccc(cc1)N1Cc2c(C1=N)cccc2
STK968250
Synonyms: 6-{(2E)-2-[(2-methoxynaphthalen-1-yl)methylidene]hydrazinyl}[1,2,4]triazolo[4,3-b]pyridazine
Smiles: COc1ccc2c(c1/C=N/Nc1ccc3n(n1)cnn3)cccc2
STK968251
Synonyms: methyl4-[4-(2-hydroxy-4-methoxy-3-methylphenyl)-2-methyl-6-(trifluoromethyl)pyrimidin-5-yl]-5-methylfuran-2-carboxylate
Smiles: COC(=O)c1cc(c(o1)C)c1c(nc(nc1C(F)(F)F)C)c1ccc(c(c1O)C)OC
STK968252
Synonyms: 2-({2-[(4-bromophenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-6-oxo-1,6-dihydropyridine-3-carboxamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1[nH]c(=O)cc(c1C(=O)N)C
STK968253
Synonyms: 2-methoxyethyl6-methyl-2-oxo-4-(quinolin-6-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: COCCOC(=O)C1=C(C)NC(=O)NC1c1ccc2c(c1)cccn2
STK968254
Synonyms: 4-[3-(benzyloxy)-4-methoxyphenyl]-6-phenyl-3,4-dihydropyrimidine-2(1H)-thione
Smiles: COc1ccc(cc1OCc1ccccc1)C1NC(=S)NC(=C1)c1ccccc1
STK968255
Synonyms: N-[(3,4-dimethoxyphenyl)(2-methyl-1H-indol-3-yl)methyl]pyridin-2-amine
Smiles: COc1ccc(cc1OC)C(c1c(C)[nH]c2c1cccc2)Nc1ccccn1
STK968256
Synonyms: 2-[(4-amino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(2-methoxyethyl)acetamide
Smiles: COCCNC(=O)CSc1nc(N)c2c(n1)sc1c2CCCC1
STK968257
Synonyms: 4-(4-chlorophenyl)-1-methyl-4,6,7,8-tetrahydroquinazoline-2,5(1H,3H)-dione
Smiles: Clc1ccc(cc1)C1NC(=O)N(C2=C1C(=O)CCC2)C
STK968258
Synonyms: 1,7,7-trimethyl-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinazoline-2,5(1H,3H)-dione
Smiles: CN1C(=O)NC(C2=C1CC(C)(C)CC2=O)c1ccc(cc1)C(F)(F)F
STK968259
Synonyms: 4-(3-ethoxy-4-hydroxyphenyl)-1-methyl-4,6,7,8-tetrahydroquinazoline-2,5(1H,3H)-dione
Smiles: CCOc1cc(ccc1O)C1NC(=O)N(C2=C1C(=O)CCC2)C
STK968260
Synonyms: 4-cyanophenyl(trifluoroacetyl)carbamate
Smiles: N#Cc1ccc(cc1)OC(=O)NC(=O)C(F)(F)F
STK968261
Synonyms: 1-[(3,4-dimethoxybenzyl)oxy]-3-(2,6-dimethylpiperidin-1-yl)propan-2-ol
Smiles: COc1cc(COCC(CN2C(C)CCCC2C)O)ccc1OC
STK968262
Synonyms: 5-ethoxy-2-[5-methyl-4-(4-propylphenyl)-1H-pyrazol-3-yl]phenol
Smiles: CCCc1ccc(cc1)c1c(C)[nH]nc1c1ccc(cc1O)OCC
STK968263
Synonyms: 1-(4-benzylpiperazin-1-yl)-3-[(3,4,5-trimethoxybenzyl)oxy]propan-2-ol
Smiles: COc1cc(COCC(CN2CCN(CC2)Cc2ccccc2)O)cc(c1OC)OC
STK968264
Synonyms: 1-[(4-tert-butylcyclohexyl)oxy]-4,4-dimethylpentan-2-ol
Smiles: OC(CC(C)(C)C)COC1CCC(CC1)C(C)(C)C
STK968265
Synonyms: N-[(2-methyl-1H-indol-3-yl)(thiophen-2-yl)methyl]pyridin-2-amine
Smiles: Cc1[nH]c2c(c1C(c1cccs1)Nc1ccccn1)cccc2
STK968266
Synonyms: N~2~-[2-(dimethylamino)ethyl]-9-ethyl-N~6~-(3-nitrophenyl)-9H-purine-2,6-diamine
Smiles: CCn1cnc2c1nc(NCCN(C)C)nc2Nc1cccc(c1)[N+](=O)[O-]
STK968267
Synonyms: 4-acetyl-5-methyl-2-(propan-2-yl)phenyl(phenylcarbonyl)carbamate
Smiles: O=C(NC(=O)c1ccccc1)Oc1cc(C)c(cc1C(C)C)C(=O)C
STK968268
Synonyms: 3-methyl-1,6-diphenyl-1,6-dihydrodipyrazolo[3,4-b:4',3'-e]pyridine
Smiles: Cc1nn(c2c1cc1cn(nc1n2)c1ccccc1)c1ccccc1
STK968269
Synonyms: 5-[2-(4-fluorophenyl)-2-oxoethoxy]-4-(4-methoxyphenyl)-7-methyl-2H-chromen-2-one
Smiles: COc1ccc(cc1)c1cc(=O)oc2c1c(OCC(=O)c1ccc(cc1)F)cc(c2)C
STK968270
Synonyms: N-ethyl-4-methoxy-6-{[6-(3-methylbutoxy)pyridazin-3-yl]oxy}-1,3,5-triazin-2-amine
Smiles: CCNc1nc(Oc2ccc(nn2)OCCC(C)C)nc(n1)OC
STK968271
Synonyms: 4-{[(2Z)-3-ethyl-4-methyl-1,3-thiazol-2(3H)-ylidene]amino}phenol
Smiles: CCn1c(C)cs/c/1=N\c1ccc(cc1)O
STK968272
Synonyms: ethyl7,8-dihydroxy-3-(2-methyl-1,3-thiazol-4-yl)-4-oxo-4H-chromene-2-carboxylate
Smiles: CCOC(=O)c1oc2c(O)c(O)ccc2c(=O)c1c1csc(n1)C
STK968273
Synonyms: 2-(4-fluorophenyl)-1-(2,3,4-trihydroxyphenyl)ethanone
Smiles: Fc1ccc(cc1)CC(=O)c1ccc(c(c1O)O)O
STK968274
Synonyms: (1E,2E)-N,N'-bis(benzyloxy)ethane-1,2-diimine
Smiles: N(=C\C=N\OCc1ccccc1)/OCc1ccccc1
STK968275
Synonyms: 3-(azepan-1-ylmethyl)-6-chloro-2-methylquinolin-4-ol
Smiles: Clc1ccc2c(c1)c(O)c(c(n2)C)CN1CCCCCC1
STK968279
Synonyms: [(4-fluorophenyl)(5-hydroxy-2-methyl-1H-imidazol-4-yl)methyl]propanedinitrile
Smiles: N#CC(C(c1nc([nH]c1O)C)c1ccc(cc1)F)C#N
STK968283
Synonyms: 4-chloro-3-[(1H-tetrazol-1-ylacetyl)amino]benzoicacid
Smiles: O=C(Nc1cc(ccc1Cl)C(=O)O)Cn1cnnn1
STK968286
Synonyms: 2-(2-{(Z)-[3-methyl-1-(3-methylphenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}phenoxy)acetamide
Smiles: NC(=O)COc1ccccc1/C=C\1/C(=NN(C1=O)c1cccc(c1)C)C
STK968287
Synonyms: methyl(9Z)-9-(2,4-dichlorobenzylidene)-6a-methyl-10-oxo-6,6a,9,10-tetrahydro-11aH-[1]benzofuro[2,3-e]cyclopropa[d][1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: COC(=O)C1C23C1(C)N=c1n(C3c3c(O2)cccc3)c(=O)/c(=C/c2ccc(cc2Cl)Cl)/s1
STK968290
Synonyms: 4-(1,3-benzodioxol-5-yloxy)-5-(4-chlorophenyl)thieno[2,3-d]pyrimidine
Smiles: Clc1ccc(cc1)c1csc2c1c(ncn2)Oc1ccc2c(c1)OCO2
STK968291
Synonyms: 7-methoxy-3-(4-propylphenoxy)-4H-chromen-4-one
Smiles: CCCc1ccc(cc1)Oc1coc2c(c1=O)ccc(c2)OC
STK968292
Synonyms: 4-[4-phenoxy-5-(trifluoromethyl)-1H-pyrazol-3-yl]benzene-1,2,3-triol
Smiles: Oc1ccc(c(c1O)O)c1n[nH]c(c1Oc1ccccc1)C(F)(F)F
STK968293
Synonyms: 6-ethyl-7-hydroxy-3-(1-phenyl-1H-pyrazol-4-yl)-8-(piperidin-1-ylmethyl)-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: CCc1cc2c(=O)c(c3cnn(c3)c3ccccc3)c(oc2c(c1O)CN1CCCCC1)C(F)(F)F
STK968294
Synonyms: methyl(2E)-2-[4-(acetyloxy)benzylidene]-5-(2-chlorophenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: COC(=O)C1=C(C)N=c2n(C1c1ccccc1Cl)c(=O)/c(=C\c1ccc(cc1)OC(=O)C)/s2
STK968295
Synonyms: N,N'-propane-1,2-diylbis(3,5-dimethoxybenzamide)
Smiles: COc1cc(OC)cc(c1)C(=O)NCC(NC(=O)c1cc(OC)cc(c1)OC)C
STK968296
Synonyms: 3,3'-(pyridin-3-ylmethanediyl)bis(4-hydroxy-6-methyl-2H-pyran-2-one)
Smiles: Cc1cc(O)c(c(=O)o1)C(c1c(O)cc(oc1=O)C)c1cccnc1
STK968297
Synonyms: 2-{1-[4-(dimethylamino)phenyl]-3-oxo-3-phenylpropyl}cyclohexanone
Smiles: O=C1CCCCC1C(c1ccc(cc1)N(C)C)CC(=O)c1ccccc1
STK968298
Synonyms: N-(2,4-diphenyl-1,3-thiazol-5-yl)ethanediamide
Smiles: NC(=O)C(=O)Nc1sc(nc1c1ccccc1)c1ccccc1
STK968299
Synonyms: (2E)-N-(2-methylphenyl)-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enamide
Smiles: O=C(Nc1ccccc1C)/C=C/c1ccc(o1)c1cccc(c1)[N+](=O)[O-]
STK968300
Synonyms: 6-fluoro-3-hydroxy-2-(3-nitrophenyl)-4H-chromen-4-one
Smiles: Fc1ccc2c(c1)c(=O)c(c(o2)c1cccc(c1)[N+](=O)[O-])O
STK968301
Synonyms: 2-oxo-2-[4-(5-phenyl-1H-1,2,3-triazol-1-yl)phenyl]ethylfuran-2-carboxylate
Smiles: O=C(c1ccc(cc1)n1nncc1c1ccccc1)COC(=O)c1ccco1
STK968302
Synonyms: 4-phenyl-4-(trifluoromethyl)-1,3,5-oxadiazinane-2,6-dione
Smiles: FC(C1(NC(=O)OC(=O)N1)c1ccccc1)(F)F
STK968303
Synonyms: 1-methyl-1H-pyrazolo[3,4-b]quinoline
Smiles: Cn1ncc2c1nc1ccccc1c2
STK968304
Synonyms: 4-methoxy-2,3-dimethyl-N-[2-(morpholin-4-yl)ethyl]benzenesulfonamide
Smiles: COc1ccc(c(c1C)C)S(=O)(=O)NCCN1CCOCC1
STK968305
Synonyms: [3-(1,1-dioxidotetrahydrothiophen-3-yl)-5,6-dimethyl-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl](4-methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)N1CN(Cc2c1sc(c2C)C)C1CCS(=O)(=O)C1
STK968306
Synonyms: [5-chloro-2-(methylsulfanyl)pyrimidin-4-yl](2,3-dihydro-1H-indol-1-yl)methanone
Smiles: CSc1ncc(c(n1)C(=O)N1CCc2c1cccc2)Cl
STK968307
Synonyms: N-benzyl-2-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide
Smiles: O=C(CC1CCS(=O)(=O)C1)NCc1ccccc1
STK968309
Synonyms: 4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-6-methyl-N-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Smiles: CCn1nc(c(c1)C1NC(=S)NC(=C1C(=O)Nc1ccccc1)C)C
STK968310
Synonyms: (2Z,6E)-2,6-bis[(1-methyl-1H-pyrazol-3-yl)methylidene]cyclohexanone
Smiles: O=C1/C(=C/c2ccn(n2)C)/CCC/C/1=C/c1ccn(n1)C
STK968311
Synonyms: ethyl3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate
Smiles: CCOC(=O)c1cc(nn1C)C(=O)n1nc(c(c1C)Br)C
STK968312
Synonyms: 5-(1,3-dimethyl-1H-pyrazol-5-yl)-N-ethyl-1,3,4-thiadiazol-2-amine
Smiles: CCNc1nnc(s1)c1cc(nn1C)C
STK968313
Synonyms: 5-(4-bromo-1,5-dimethyl-1H-pyrazol-3-yl)-N-(2-methylpropyl)-1,3,4-thiadiazol-2-amine
Smiles: CC(CNc1nnc(s1)c1nn(c(c1Br)C)C)C
STK968314
Synonyms: 5-bromo-N'-[(E)-(2-propoxyphenyl)methylidene]-1-benzofuran-2-carbohydrazide
Smiles: CCCOc1ccccc1/C=N/NC(=O)c1cc2c(o1)ccc(c2)Br
STK968315
Synonyms: 4-[4-(dimethylamino)phenyl]-6-oxo-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-1,6-dihydropyrimidine-5-carbonitrile
Smiles: N#Cc1c(=O)[nH]c(nc1c1ccc(cc1)N(C)C)SCC(=O)N1CCCCC1
STK968316
Synonyms: methyl3-[({5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-yl}carbonyl)amino]thiophene-2-carboxylate
Smiles: COC(=O)c1sccc1NC(=O)c1ccc(o1)Cn1nc(c(c1C)Br)C
STK968318
Synonyms: methyl6-tert-butyl-2-({[7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)c2nn3c(n2)nc(cc3C(F)F)C)sc2c1CCC(C2)C(C)(C)C
STK968319
Synonyms: 4-(4-bromophenyl)-N,N-diethyl-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Smiles: CCN(C(=O)C1=C(C)NC(=O)NC1c1ccc(cc1)Br)CC
STK968321
Synonyms: 2-{[5-cyano-4-(4-methoxyphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(5-methyl-1,2-oxazol-3-yl)butanamide
Smiles: CCC(C(=O)Nc1noc(c1)C)Sc1nc(c2ccc(cc2)OC)c(c(=O)[nH]1)C#N
STK968324
Synonyms: N-(4-acetylphenyl)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)O1)C)Nc1ccc(cc1)C(=O)C
STK968325
Synonyms: N-butyl-5-(4-chloro-1,5-dimethyl-1H-pyrazol-3-yl)-1,3,4-thiadiazol-2-amine
Smiles: CCCCNc1nnc(s1)c1nn(c(c1Cl)C)C
STK968326
Synonyms: 5-(4-bromo-1,5-dimethyl-1H-pyrazol-3-yl)-4-(2-methylpropyl)-4H-1,2,4-triazole-3-thiol
Smiles: CC(Cn1c(S)nnc1c1nn(c(c1Br)C)C)C
STK968327
Synonyms: ethyl3-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]-1-methyl-1H-pyrazole-5-carboxylate
Smiles: CCOC(=O)c1cc(nn1C)C(=O)Nc1sc2c(c1C#N)CCC2
STK968328
Synonyms: 4-iodo-1-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]-1H-pyrazole-5-carboxamide
Smiles: S=C(NC(=O)c1c(I)cnn1C)Nc1ccc(cc1)S(=O)(=O)N
STK968330
Synonyms: 5-(4-bromophenyl)-N-tert-butyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Smiles: Brc1ccc(cc1)c1cc(n2c(n1)c(cn2)C(=O)NC(C)(C)C)C(F)(F)F
STK968331
Synonyms: 2-[(2,4-dimethylphenyl)amino]-N'-[(E)-naphthalen-1-ylmethylidene]butanehydrazide
Smiles: CCC(C(=O)N/N=C/c1cccc2c1cccc2)Nc1ccc(cc1C)C
STK968332
Synonyms: (4Z)-4-{[5-(4-bromophenyl)furan-2-yl]methylidene}-5-methyl-2-(3-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: Brc1ccc(cc1)c1ccc(o1)/C=C\1/C(=NN(C1=O)c1cccc(c1)C)C
STK968333
Synonyms: ethyl4-{3-methoxy-4-[(4-nitrobenzyl)oxy]phenyl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)OCc1ccc(cc1)[N+](=O)[O-])C(=O)CC(C2)(C)C
STK968334
Synonyms: 2-{[2-(9H-fluoren-2-yl)-2-oxoethyl]sulfanyl}-4,5,6-trimethylpyridine-3-carbonitrile
Smiles: N#Cc1c(SCC(=O)c2ccc3c(c2)Cc2c3cccc2)nc(c(c1C)C)C
STK968336
Synonyms: 4-bromo-N-(2,4-dichlorobenzyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide
Smiles: Clc1ccc(c(c1)Cl)CNC(=O)c1n(C)nc(c1Br)C
STK968337
Synonyms: 1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-3-tricyclo[3.3.1.1~3,7~]dec-1-ylurea
Smiles: CCn1ncc(c1C)CNC(=O)NC12CC3CC(C2)CC(C1)C3
STK968340
Synonyms: 1-(2,4-difluorophenyl)-2-({5-[(2-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)ethanone
Smiles: Fc1ccc(c(c1)F)C(=O)CSc1nnc(o1)COc1ccccc1C
STK968347
Synonyms: 5-[(4-chlorobenzyl)oxy]-2-[5-(4-chlorophenyl)-2-methylpyrimidin-4-yl]phenol
Smiles: Clc1ccc(cc1)COc1ccc(c(c1)O)c1nc(C)ncc1c1ccc(cc1)Cl
STK968348
Synonyms: 6-({3-cyano-5-methyl-4-[4-(propan-2-yl)phenyl]thiophen-2-yl}carbamoyl)-3,4-dimethylcyclohex-3-ene-1-carboxylicacid
Smiles: N#Cc1c(NC(=O)C2CC(=C(CC2C(=O)O)C)C)sc(c1c1ccc(cc1)C(C)C)C
STK968350
Synonyms: 2-[(4-bromo-1,5-dimethyl-1H-pyrazol-3-yl)carbonyl]-N-(furan-2-ylmethyl)hydrazinecarbothioamide
Smiles: S=C(NCc1ccco1)NNC(=O)c1nn(c(c1Br)C)C
STK968351
Synonyms: 4-[(2-bromophenoxy)methyl]-N-(4-bromo-2,3,5,6-tetrafluorophenyl)benzamide
Smiles: O=C(c1ccc(cc1)COc1ccccc1Br)Nc1c(F)c(F)c(c(c1F)F)Br
STK968352
Synonyms: N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]bicyclo[2.2.1]heptane-2-carboxamide
Smiles: O=C(C1CC2CC1CC2)Nc1ccc(cc1)S(=O)(=O)Nc1nccs1
STK968353
Synonyms: propan-2-yl5'-cyano-2'-methyl-6'-sulfanyl-1',4'-dihydro-3,4'-bipyridine-3'-carboxylate
Smiles: N#CC1=C(S)NC(=C(C1c1cccnc1)C(=O)OC(C)C)C
STK968354
Synonyms: 5-(4-bromophenyl)-3-chloro-N-(3-hydroxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: Brc1ccc(cc1)c1cc(n2c(n1)c(Cl)c(n2)C(=O)Nc1cccc(c1)O)C(F)(F)F
STK968355
Synonyms: dimethyl3-methyl-5-{[(1-oxo-1H-isochromen-3-yl)carbonyl]amino}thiophene-2,4-dicarboxylate
Smiles: COC(=O)c1c(NC(=O)c2cc3ccccc3c(=O)o2)sc(c1C)C(=O)OC
STK968356
Synonyms: N'-[(1E)-1-(2-hydroxyphenyl)propylidene]cyclohexanecarbohydrazide
Smiles: CC/C(=N\NC(=O)C1CCCCC1)/c1ccccc1O
STK968357
Synonyms: ethyl4-(2-bromo-5-methoxy-4-propoxyphenyl)-2-oxo-6-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCCOc1cc(Br)c(cc1OC)C1NC(=O)NC(=C1C(=O)OCC)c1ccccc1
STK968358
Synonyms: 2-(2-chlorophenyl)-N'-[(E)-(3-hydroxyphenyl)methylidene]quinoline-4-carbohydrazide
Smiles: Oc1cccc(c1)/C=N/NC(=O)c1cc(nc2c1cccc2)c1ccccc1Cl
STK968364
Synonyms: N-[3-(acetylamino)phenyl]-7-(difluoromethyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Smiles: CC(=O)Nc1cccc(c1)NC(=O)c1cnn2c1nc(cc2C(F)F)c1ccc(cc1)C
STK968370
Synonyms: ethyl5-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-methyl-4-oxo-2-thioxo-1,2,3,4,5,8-hexahydropyrido[2,3-d]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)Nc2c(C1c1ccc3c(c1)OCCO3)c(=O)[nH]c(=S)[nH]2
STK968372
Synonyms: (2E)-N-(3-{[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}propyl)-3-(5-nitrofuran-2-yl)prop-2-enamide
Smiles: O=C(/C=C/c1ccc(o1)[N+](=O)[O-])NCCCSc1nc(cc(n1)C(F)(F)F)C(C)(C)C
STK968375
Synonyms: N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
Smiles: Cc1ccc(o1)c1nc2ccccc2c(c1)C(=O)Nc1nnc(s1)CC(C)(C)C
STK968377
Synonyms: ethyl3-[(4-chloro-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate
Smiles: Cn1nc(cc1C(=O)OCC)C(=O)n1cc(cn1)Cl
STK968378
Synonyms: 5-{[3,5-bis(difluoromethyl)-1H-pyrazol-1-yl]methyl}-4-(4-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1)n1c(S)nnc1Cn1nc(cc1C(F)F)C(F)F
STK968379
Synonyms: N'-[(Z)-(1,3-diphenyl-1H-pyrazol-4-yl)methylidene]-2-(naphthalen-2-yloxy)acetohydrazide
Smiles: O=C(COc1ccc2c(c1)cccc2)N/N=C\c1cn(nc1c1ccccc1)c1ccccc1
STK968380
Synonyms: 2-[(2E)-2-(5-bromo-2-hydroxy-3-nitrobenzylidene)hydrazinyl]-N-(naphthalen-1-yl)-2-oxoacetamide
Smiles: Brc1cc(/C=N/NC(=O)C(=O)Nc2cccc3c2cccc3)c(c(c1)[N+](=O)[O-])O
STK968381
Synonyms: (2-bromo-6-methoxy-4-{(E)-[(2Z)-2-(naphthalen-1-ylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetonitrile
Smiles: N#CCOc1c(Br)cc(cc1OC)/C=C\1/S/C(=N\c2cccc3c2cccc3)/NC1=O
STK968382
Synonyms: 2-bromo-6-methoxy-4-[(Z)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenylacetate
Smiles: COc1cc(/C=C\2/C(=NN(C2=O)c2ccccc2)C)cc(c1OC(=O)C)Br
STK968383
Synonyms: (6-fluoro-2-methyl-3,4-dihydroquinolin-1(2H)-yl)(3-methylthiophen-2-yl)methanone
Smiles: Fc1ccc2c(c1)CCC(N2C(=O)c1sccc1C)C
STK968384
Synonyms: N-[4-(benzyloxy)phenyl]-4-chloro-5-nitro-1H-pyrazole-3-carboxamide
Smiles: O=C(c1n[nH]c(c1Cl)[N+](=O)[O-])Nc1ccc(cc1)OCc1ccccc1
STK968385
Synonyms: N-(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
Smiles: NC(=O)c1c(sc2c1CCC2)NC(=O)c1cnn2c1nc(cc2C(F)F)c1ccccc1
STK968386
Synonyms: 2-amino-4-{5-[(2-chloro-4-fluorophenoxy)methyl]furan-2-yl}-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile
Smiles: N#CC1=C(N)C(C(C2C1=CCCC2)c1ccc(o1)COc1ccc(cc1Cl)F)(C#N)C#N
STK968390
Synonyms: (6-fluoro-2-methyl-3,4-dihydroquinolin-1(2H)-yl)[2-(trifluoromethyl)furan-3-yl]methanone
Smiles: Fc1ccc2c(c1)CCC(N2C(=O)c1ccoc1C(F)(F)F)C
STK968392
Synonyms: N-(5-methyl-1,2-oxazol-3-yl)-2-[(5-methyl-1,2-oxazol-3-yl)amino]-2,2-diphenylacetamide
Smiles: Cc1onc(c1)NC(=O)C(c1ccccc1)(c1ccccc1)Nc1noc(c1)C
STK968393
Synonyms: 5-(4-chloro-1-methyl-1H-pyrazol-3-yl)-N-(2-methylpropyl)-1,3,4-thiadiazol-2-amine
Smiles: CC(CNc1nnc(s1)c1nn(cc1Cl)C)C
STK968394
Synonyms: 5-[(2,5-dichlorophenoxy)methyl]-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]furan-2-carboxamide
Smiles: COc1ccc(cc1c1csc(n1)NC(=O)c1ccc(o1)COc1cc(Cl)ccc1Cl)OC
STK968395
Synonyms: propan-2-yl2-chloro-5-(5-{(E)-[2-(1H-tetrazol-5-yl)hydrazinylidene]methyl}furan-2-yl)benzoate
Smiles: CC(OC(=O)c1cc(ccc1Cl)c1ccc(o1)/C=N/Nc1nnn[nH]1)C
STK968396
Synonyms: (4-{(Z)-[1-(4-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-iodo-6-methoxyphenoxy)acetonitrile
Smiles: N#CCOc1c(I)cc(cc1OC)/C=C\1/C(=NN(C1=O)c1ccc(cc1)Cl)C
STK968397
Synonyms: N,N'-cyclohexane-1,4-diylbis(4-methoxybenzenesulfonamide)
Smiles: COc1ccc(cc1)S(=O)(=O)NC1CCC(CC1)NS(=O)(=O)c1ccc(cc1)OC
STK968399
Synonyms: methyl4-(3-ethoxy-4-{2-[(4-methylphenyl)amino]-2-oxoethoxy}phenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOc1cc(ccc1OCC(=O)Nc1ccc(cc1)C)C1NC(=S)NC(=C1C(=O)OC)C
STK968400
Synonyms: 5-(4-bromophenyl)-N-(3-hydroxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: Brc1ccc(cc1)C1Nc2cc(nn2C(C1)C(F)(F)F)C(=O)Nc1cccc(c1)O
STK968407
Synonyms: N-ethyl-5-[2-(4-methyl-1H-pyrazol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine
Smiles: CCNc1nnc(s1)CCn1ncc(c1)C
STK968409
Synonyms: N'~1~,N'~5~-bis[(E)-quinolin-8-ylmethylidene]pentanedihydrazide
Smiles: O=C(N/N=C/c1cccc2c1nccc2)CCCC(=O)N/N=C/c1cccc2c1nccc2
STK968410
Synonyms: N-(2-{4-[5-(acetylamino)-1H-benzimidazol-2-yl]phenyl}-1,3-benzoxazol-5-yl)acetamide
Smiles: CC(=O)Nc1ccc2c(c1)nc(o2)c1ccc(cc1)c1nc2c([nH]1)ccc(c2)NC(=O)C
STK968411
Synonyms: (2-bromo-6-ethoxy-4-{(Z)-[3-methyl-1-(4-methylphenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}phenoxy)acetonitrile
Smiles: N#CCOc1c(Br)cc(cc1OCC)/C=C\1/C(=NN(C1=O)c1ccc(cc1)C)C
STK968412
Synonyms: ethyl{2-methoxy-4-[(Z)-(5-oxo-2-phenyl-1,3-oxazol-4(5H)-ylidene)methyl]phenoxy}acetate
Smiles: CCOC(=O)COc1ccc(cc1OC)/C=C/1\N=C(OC1=O)c1ccccc1
STK968417
Synonyms: N,N-dimethyl-4-(4-{(Z)-[4-oxo-2-(piperidin-1-yl)-1,3-thiazol-5(4H)-ylidene]methyl}-1-phenyl-1H-pyrazol-3-yl)benzenesulfonamide
Smiles: O=C1N=C(S/C/1=C\c1cn(nc1c1ccc(cc1)S(=O)(=O)N(C)C)c1ccccc1)N1CCCCC1
STK968418
Synonyms: 1-(3,5-dimethylpiperidin-1-yl)-3-(propan-2-yloxy)propan-2-ol
Smiles: OC(CN1CC(C)CC(C1)C)COC(C)C
STK968419
Synonyms: 4-bromo-1-methyl-N-[4-(1H-pyrazol-1-yl)benzyl]-1H-pyrazole-3-carboxamide
Smiles: Cn1cc(c(n1)C(=O)NCc1ccc(cc1)n1cccn1)Br
STK968421
Synonyms: 4-chloro-N'-[(E)-(2,3-dichlorophenyl)methylidene]-1-methyl-1H-pyrazole-3-carbohydrazide
Smiles: Cn1nc(c(c1)Cl)C(=O)N/N=C/c1cccc(c1Cl)Cl
STK968423
Synonyms: 2-amino-4-{4-methoxy-3-[(pentafluorophenoxy)methyl]phenyl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: COc1ccc(cc1COc1c(F)c(F)c(c(c1F)F)F)c1c(C#N)c(N)nc2c1CCCC2
STK968425
Synonyms: N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: N#Cc1c(NC(=O)c2nn3c(n2)nc(cc3C(F)F)C)sc(c1CC)C
STK968428
Synonyms: N-(2-benzylphenyl)-7-(difluoromethyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Smiles: Cc1ccc(cc1)c1cc(C(F)F)n2c(n1)c(cn2)C(=O)Nc1ccccc1Cc1ccccc1
STK968433
Synonyms: 3-(4-bromophenyl)-4,5-dihydro-1H-furo[2,3-g]indazole
Smiles: Brc1ccc(cc1)c1n[nH]c2c1CCc1c2cco1
STK968434
Synonyms: methyl4-{4-[(4-bromophenoxy)methyl]-5-methylthiophen-2-yl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: COC(=O)C1=C(C)NC2=C(C1c1cc(c(s1)C)COc1ccc(cc1)Br)C(=O)CCC2
STK968436
Synonyms: ethyl2-{[(4-bromo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-5-(1-phenylethyl)thiophene-3-carboxylate
Smiles: CCOC(=O)c1cc(sc1NC(=O)c1nn(cc1Br)C)C(c1ccccc1)C
STK968437
Synonyms: (2Z,6E)-2,6-bis[(1-methyl-1H-pyrazol-4-yl)methylidene]cyclohexanone
Smiles: Cn1ncc(c1)/C=C/1\CCC/C(=C/c2cnn(c2)C)/C1=O
STK968438
Synonyms: 6-tert-butyl-N-[1-(pyridin-4-yl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: O=C(c1csc2c1CCC(C2)C(C)(C)C)NC(c1ccncc1)C
STK968439
Synonyms: (4E)-2-(2-fluorophenyl)-4-(3-iodo-4,5-dimethoxybenzylidene)-1,3-oxazol-5(4H)-one
Smiles: COc1c(I)cc(cc1OC)/C=C\1/N=C(OC1=O)c1ccccc1F
STK968441
Synonyms: (4Z)-2-(3-bromophenyl)-4-{3-ethoxy-4-[(2-methylprop-2-en-1-yl)oxy]benzylidene}-1,3-oxazol-5(4H)-one
Smiles: CCOc1cc(ccc1OCC(=C)C)/C=C/1\N=C(OC1=O)c1cccc(c1)Br
STK968444
Synonyms: N-(3,4-dichlorophenyl)-7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: Cc1cc(C(F)F)n2c(n1)nc(n2)C(=O)Nc1ccc(c(c1)Cl)Cl
STK968448
Synonyms: 4-cyano-5-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-N,N,3-trimethylthiophene-2-carboxamide
Smiles: N#Cc1c(sc(c1C)C(=O)N(C)C)N1C(=O)C2C(C1=O)C1OC2CC1
STK968449
Synonyms: {4-hydroxy-2-thioxo-4-(trifluoromethyl)-6-[4-(trifluoromethyl)phenyl]hexahydropyrimidin-5-yl}(thiophen-2-yl)methanone
Smiles: S=C1NC(c2ccc(cc2)C(F)(F)F)C(C(N1)(O)C(F)(F)F)C(=O)c1cccs1
STK968450
Synonyms: 2-(4-chlorophenyl)-3-[2-(morpholin-4-yl)ethyl]-1,3-thiazolidin-4-one
Smiles: O=C1CSC(N1CCN1CCOCC1)c1ccc(cc1)Cl
STK968451
Synonyms: (2E)-2-[(1,5-dimethyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-N-phenyl-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Smiles: O=C(C1=C(C)N=c2n(C1c1cccs1)c(=O)/c(=C\c1cnn(c1C)C)/s2)Nc1ccccc1
STK968452
Synonyms: 6-bromo-N'-[(4-butoxyphenoxy)acetyl]-2-oxo-2H-chromene-3-carbohydrazide
Smiles: CCCCOc1ccc(cc1)OCC(=O)NNC(=O)c1cc2cc(Br)ccc2oc1=O
STK968454
Synonyms: 4-bromo-N-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-spiro[2-aza-4,7-methanoisoindole-8,1'-cyclopropan]-2-yl)-1-methyl-1H-pyrazole-3-carboxamide
Smiles: O=C1N(NC(=O)c2nn(cc2Br)C)C(=O)C2C1C1C=CC2C21CC2
STK968455
Synonyms: 3-bromo-5-(thiophen-2-yl)-N-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: O=C(c1nn2c(c1Br)NC(CC2C(F)(F)F)c1cccs1)NC12CC3CC(C2)CC(C1)C3
STK968456
Synonyms: 3-(1H-1,2,4-triazol-1-yl)-N-[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Smiles: O=C(C12CC3CC(C1)CC(C2)(C3)n1cncn1)NC(C12CC3CC(C2)CC(C1)C3)C
STK968470
Synonyms: 3-chloro-2-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}imidazo[1,2-a]pyridine
Smiles: Clc1c(CSc2nnnn2c2ccccc2)nc2n1cccc2
STK968471
Synonyms: 2-(4-methoxyphenyl)-1,2,2',3',5',6'-hexahydro-3H-spiro[isoquinoline-4,4'-pyran]-3-imine
Smiles: COc1ccc(cc1)N1Cc2ccccc2C2(C1=N)CCOCC2
STK968472
Synonyms: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-{[2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]oxy}-4H-chromen-4-one
Smiles: OCC1CC(Oc2ccc3c(c2)occ(c3=O)c2ccc3c(c2)OCCO3)C(C(C1O)O)O
STK968473
Synonyms: 2-[(2Z)-2-(4-bromobenzylidene)hydrazinyl]-4,5-dimethyl-1,3-thiazole
Smiles: Brc1ccc(cc1)/C=N\Nc1sc(c(n1)C)C
STK968474
Synonyms: 2-[(2Z)-2-(2-bromobenzylidene)hydrazinyl]-4,5-dimethyl-1,3-thiazole
Smiles: Brc1ccccc1/C=N\Nc1sc(c(n1)C)C
STK968475
Synonyms: 2-(2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)-2,3-dihydrophthalazine-1,4-dione
Smiles: CCc1nc2sc3c(c2c(n1)n1[nH]c(=O)c2c(c1=O)cccc2)CCCC3
STK968476
Synonyms: 6-[(5E)-5-{4-[2-(2-methoxyphenoxy)ethoxy]benzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoicacid
Smiles: COc1ccccc1OCCOc1ccc(cc1)/C=C\1/SC(=S)N(C1=O)CCCCCC(=O)O
STK968477
Synonyms: N-(2-ethoxyphenyl)-2-[3-oxo-1-(phenoxyacetyl)-1,2,3,4-tetrahydroquinoxalin-2-yl]acetamide
Smiles: CCOc1ccccc1NC(=O)CC1C(=O)Nc2c(N1C(=O)COc1ccccc1)cccc2
STK968480
Synonyms: ethyl2,7,7-trimethyl-5-oxo-4-(1,3,5-trimethyl-1H-pyrazol-4-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOC(=O)C1=C(C)NC2=C(C1c1c(C)nn(c1C)C)C(=O)CC(C2)(C)C
STK968483
Synonyms: 2-{[5-(2-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(pyridin-2-yl)acetamide
Smiles: O=C(Nc1ccccn1)CSc1nnc(n1c1ccccc1)c1ccccc1Cl
STK968484
Synonyms: 1-{[5-(benzylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}-1H-benzotriazole
Smiles: c1ccc(cc1)n1c(nnc1SCc1ccccc1)Cn1nnc2c1cccc2
STK968486
Synonyms: N-(2-phenoxyethyl)-P,P-diphenylphosphinicamide
Smiles: O=P(c1ccccc1)(c1ccccc1)NCCOc1ccccc1
STK968487
Synonyms: 2,2-dichloro-1-methyl-N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]cyclopropanecarboxamide
Smiles: O=C(C1(C)CC1(Cl)Cl)Nc1nc2c(s1)cc(cc2)S(=O)(=O)C
STK968488
Synonyms: {4-[(2-bromophenoxy)methyl]phenyl}(3,5-dimethyl-1H-pyrazol-1-yl)methanone
Smiles: Cc1nn(c(c1)C)C(=O)c1ccc(cc1)COc1ccccc1Br
STK968491
Synonyms: (2E)-3-(1,5-dimethyl-1H-pyrazol-4-yl)-N-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]prop-2-enamide
Smiles: O=C(/C=C/c1cnn(c1C)C)NCc1cnn(c1C)C
STK968494
Synonyms: 3-hydroxy-7,8,9-trimethoxy-6H-benzo[c]chromen-6-one
Smiles: COc1cc2c3ccc(cc3oc(=O)c2c(c1OC)OC)O
STK968495
Synonyms: N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-4-(4-ethylphenoxy)butanamide
Smiles: CCc1ccc(cc1)OCCCC(=O)Nc1scc(n1)c1ccc(cc1)Br
STK968496
Synonyms: 4-(4-ethylphenoxy)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]butanamide
Smiles: CCc1ccc(cc1)OCCCC(=O)Nc1ccc(cc1)c1nc2c(s1)cc(cc2)C
STK968497
Synonyms: N-{4-[(2-chlorobenzyl)oxy]phenyl}-2-(4-nitrophenyl)quinazolin-4-amine
Smiles: Clc1ccccc1COc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccc(cc1)[N+](=O)[O-]
STK968498
Synonyms: 4-(azepan-1-yl)-2-(4-nitrophenyl)quinazoline
Smiles: [O-][N+](=O)c1ccc(cc1)c1nc2ccccc2c(n1)N1CCCCCC1
STK968499
Synonyms: 2-benzyl-1H-pyrrolo[3',4':4,5]imidazo[1,2-a]pyridine-1,3(2H)-dione
Smiles: O=c1c2c(c(=O)n1Cc1ccccc1)nc1n2cccc1
STK968500
Synonyms: 2-(3-chlorophenoxy)-N-(2-methoxyphenyl)acetamide
Smiles: COc1ccccc1NC(=O)COc1cccc(c1)Cl
STK968501
Synonyms: pentyl4-{[(2-methylphenoxy)acetyl]amino}benzoate
Smiles: CCCCCOC(=O)c1ccc(cc1)NC(=O)COc1ccccc1C
STK968502
Synonyms: N-(4-butoxyphenyl)-2-(thiophen-2-ylmethylidene)hydrazinecarboxamide
Smiles: CCCCOc1ccc(cc1)NC(=O)N/N=C/c1cccs1
STK968503
Synonyms: 1-(azepan-1-yl)-2-(2-nitrophenoxy)ethanone
Smiles: O=C(N1CCCCCC1)COc1ccccc1[N+](=O)[O-]
STK968505
Synonyms: 2-methoxy-4-[(E)-2-phenylethenyl]phenylacetate
Smiles: COc1cc(/C=C/c2ccccc2)ccc1OC(=O)C
STK968506
Synonyms: 2-methoxy-4-[(E)-2-phenylethenyl]phenylpropanoate
Smiles: CCC(=O)Oc1ccc(cc1OC)/C=C/c1ccccc1
STK968507
Synonyms: ethyl2-{[(4-tert-butylphenoxy)acetyl]amino}-4,5-dimethylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)COc2ccc(cc2)C(C)(C)C)sc(c1C)C
STK968508
Synonyms: 2-bromo-3,4,5-trimethoxy-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]benzamide
Smiles: COc1cc(C(=O)Nc2ccc(cc2)c2nc3c(s2)cc(cc3)C)c(c(c1OC)OC)Br
STK968509
Synonyms: 2-[(2-phenylquinazolin-4-yl)amino]ethanol
Smiles: OCCNc1nc(nc2c1cccc2)c1ccccc1
STK968510
Synonyms: 2-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino]-N'-[(Z)-(2-hydroxynaphthalen-1-yl)methylidene]butanehydrazide
Smiles: CCC(C(=O)N/N=C\c1c(O)ccc2c1cccc2)Nc1n[nH]c(=O)[nH]c1=O
STK968511
Synonyms: N,N-dimethyl-N'-(quinazolin-4-yl)propane-1,3-diamine
Smiles: CN(CCCNc1ncnc2c1cccc2)C
STK968512
Synonyms: N-(furan-2-ylmethyl)-2-methylquinolin-4-amine
Smiles: Cc1cc(NCc2ccco2)c2c(n1)cccc2
STK968513
Synonyms: 3-[(4-methylphenyl)amino]isoquinolin-1(2H)-one
Smiles: Cc1ccc(cc1)Nc1cc2ccccc2c(=O)[nH]1
STK968514
Synonyms: 1,3-benzothiazol-2-yl(5-chloro-6-oxo-1-phenyl-1,6-dihydropyridazin-4-yl)acetonitrile
Smiles: N#CC(c1cnn(c(=O)c1Cl)c1ccccc1)c1nc2c(s1)cccc2
STK968515
Synonyms: (2E)-3-(furan-2-yl)-1-(1-hydroxynaphthalen-2-yl)prop-2-en-1-one
Smiles: O=C(c1ccc2c(c1O)cccc2)/C=C/c1ccco1
STK968516
Synonyms: 1-(2-tert-butyl-4-methylphenoxy)-3-(2,6-dimethylpiperidin-1-yl)propan-2-ol
Smiles: OC(CN1C(C)CCCC1C)COc1ccc(cc1C(C)(C)C)C
STK968517
Synonyms: (3E)-5-methyl-3-[2-(morpholin-4-yl)-4-oxo-1,3-thiazol-5(4H)-ylidene]-1,3-dihydro-2H-indol-2-one
Smiles: Cc1ccc2c(c1)/C(=C/1\SC(=NC1=O)N1CCOCC1)/C(=O)N2
STK968518
Synonyms: ethyl2-({[(4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nc3sc4c(c3c(=O)[nH]2)CCC4)sc2c1CCCC2
STK968519
Synonyms: methyl4-{[(9-oxobicyclo[3.3.1]non-3-yl)carbonyl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)C1CC2CCCC(C1)C2=O
STK968520
Synonyms: N'-(4-nitrophenyl)-9-oxobicyclo[3.3.1]nonane-3-carbohydrazide
Smiles: O=C(C1CC2CCCC(C1)C2=O)NNc1ccc(cc1)[N+](=O)[O-]
STK968522
Synonyms: 1-phenyl-1H,6H-[1,3]thiazino[3,2-a]quinazolin-6-one
Smiles: O=c1nc2SC=CC(n2c2c1cccc2)c1ccccc1
STK968523
Synonyms: 1-(4-methylphenyl)-3-phenyltetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one5,5-dioxide
Smiles: Cc1ccc(cc1)N1C2CS(=O)(=O)CC2N(C1=O)c1ccccc1
STK968524
Synonyms: N-[2,2,2-trichloro-1-(phenylsulfonyl)ethyl]tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Smiles: O=C(C12CC3CC(C2)CC(C1)C3)NC(S(=O)(=O)c1ccccc1)C(Cl)(Cl)Cl
STK968525
Synonyms: 3-(4-methylphenyl)-2-phenyl-5-(phenylamino)-1,2,4-thiadiazol-2-ium
Smiles: Cc1ccc(cc1)c1nc(s[n+]1c1ccccc1)Nc1ccccc1
STK968526
Synonyms: 5-[(2E)-2-(2,4-dihydroxybenzylidene)hydrazinyl]-1,2,4-triazin-3(2H)-one
Smiles: Oc1ccc(c(c1)O)/C=N/Nc1cn[nH]c(=O)n1
STK968527
Synonyms: 6,6'-[benzene-1,2-diylbis(methanediylsulfanediyl)]bis(1,2,4-triazine-3,5(2H,4H)-dione)
Smiles: O=c1[nH]c(=O)[nH]nc1SCc1ccccc1CSc1n[nH]c(=O)[nH]c1=O
STK968528
Synonyms: 7-[4-(4-fluorophenyl)-5-(trifluoromethyl)-1H-pyrazol-3-yl]-3,4-dihydro-2H-1,5-benzodioxepin-6-ol
Smiles: Fc1ccc(cc1)c1c(n[nH]c1C(F)(F)F)c1ccc2c(c1O)OCCCO2
STK968529
Synonyms: (5Z)-3-(4-hydroxyphenyl)-5-(3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1cccc(c1)/C=C/1\SC(=S)N(C1=O)c1ccc(cc1)O
STK968530
Synonyms: 3-hydroxy-1-(3-methylpyridin-2-yl)-4-(phenylcarbonyl)-5-(thiophen-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C(C1=C(O)C(=O)N(C1c1cccs1)c1ncccc1C)c1ccccc1
STK968531
Synonyms: 1-(4-chloro-2-methylphenoxy)-3-[(1-phenylethyl)amino]propan-2-ol
Smiles: OC(COc1ccc(cc1C)Cl)CNC(c1ccccc1)C
STK968532
Synonyms: N-({2-[hydroxy(phenyl)phosphoryl]-1H-benzimidazol-1-yl}acetyl)alanine
Smiles: O=C(Cn1c2ccccc2nc1P(=O)(c1ccccc1)O)NC(C(=O)O)C
STK968533
Synonyms: N,N'-bis(4-fluorophenyl)-3-methylidenecyclopropane-1,2-dicarboxamide
Smiles: O=C(C1C(=C)C1C(=O)Nc1ccc(cc1)F)Nc1ccc(cc1)F
STK968534
Synonyms: N,N'-bis(4-ethoxyphenyl)-3-methylidenecyclopropane-1,2-dicarboxamide
Smiles: CCOc1ccc(cc1)NC(=O)C1C(=C)C1C(=O)Nc1ccc(cc1)OCC
STK968535
Synonyms: ethyl2-{3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}-4,5-dimethylthiophene-3-carboxylate
Smiles: CCOc1ccc2c(c1)sc(n2)SC1CC(=O)N(C1=O)c1sc(c(c1C(=O)OCC)C)C
STK968536
Synonyms: 3a,6a-dimethyl-2-propanoylhexahydro-1,4-methanocyclopenta[c]pyrrole-1(2H)-carbonitrile
Smiles: CCC(=O)N1CC2(C3(C1(C#N)CC2CC3)C)C
STK968537
Synonyms: 2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl]propanoicacid
Smiles: OC(=O)C(Sc1ncnc2c1c(cs2)c1ccccc1)C
STK968538
Synonyms: N-cyclohexyl-N'-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)ethanediamide
Smiles: O=C(C(=O)NCC1COc2c(O1)cccc2)NC1CCCCC1
STK968539
Synonyms: 4-oxo-4-(2-{3-[4-(propan-2-yloxy)phenyl]propanoyl}hydrazinyl)butanoicacid
Smiles: CC(Oc1ccc(cc1)CCC(=O)NNC(=O)CCC(=O)O)C
STK968540
Synonyms: N,N'-bis(2-methoxyethyl)piperazine-1,4-dicarbothioamide
Smiles: COCCNC(=S)N1CCN(CC1)C(=S)NCCOC
STK968541
Synonyms: 3-[(2,5-dichlorophenyl)amino]isoquinolin-1(2H)-one
Smiles: Clc1ccc(c(c1)Nc1cc2ccccc2c(=O)[nH]1)Cl
STK968542
Synonyms: 2-(biphenyl-4-yloxy)-1-{2,4-bis[(2-chlorobenzyl)oxy]phenyl}ethanone
Smiles: O=C(c1ccc(cc1OCc1ccccc1Cl)OCc1ccccc1Cl)COc1ccc(cc1)c1ccccc1
STK968543
Synonyms: 2-({6-[(4-methylphenyl)amino]-9-propyl-9H-purin-2-yl}amino)ethanol
Smiles: CCCn1cnc2c1nc(NCCO)nc2Nc1ccc(cc1)C
STK968544
Synonyms: N-[(1Z)-3-{[3-(dimethylamino)propyl]amino}-3-oxo-1-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}prop-1-en-2-yl]-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)N/C(=C\c1ccc(o1)c1cccc(c1)C(F)(F)F)/C(=O)NCCCN(C)C
STK968545
Synonyms: 2-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2,2,2-trichloro-1-(thiomorpholin-4-yl)ethyl]acetamide
Smiles: O=C(CN1C(=O)c2c(S1(=O)=O)cccc2)NC(C(Cl)(Cl)Cl)N1CCSCC1
STK968546
Synonyms: ethyl4-{[4-(pyrrolidin-1-yl)phenyl]amino}benzo[h]quinoline-3-carboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccc(cc1)N1CCCC1)ccc1c2cccc1
STK968547
Synonyms: 6-ethyl-4-oxo-3-phenoxy-4H-chromen-7-ylacetate
Smiles: CCc1cc2c(cc1OC(=O)C)occ(c2=O)Oc1ccccc1
STK968548
Synonyms: 2-[4-(4-fluorophenoxy)-1H-pyrazol-3-yl]-5-methoxyphenol
Smiles: COc1ccc(c(c1)O)c1n[nH]cc1Oc1ccc(cc1)F
STK968549
Synonyms: 8-[(dimethylamino)methyl]-6-ethyl-3-(2-fluorophenoxy)-7-hydroxy-2-methyl-4H-chromen-4-one
Smiles: CCc1cc2c(=O)c(Oc3ccccc3F)c(oc2c(c1O)CN(C)C)C
STK968550
Synonyms: [3-(furan-2-ylmethyl)-5,6-dimethyl-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl](phenyl)methanone
Smiles: O=C(N1CN(Cc2ccco2)Cc2c1sc(c2C)C)c1ccccc1
STK968551
Synonyms: 2-[(4,4-dimethyl-2-oxocyclohexyl)(3-methoxyphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione
Smiles: COc1cccc(c1)C(C1C(=O)CC(CC1=O)(C)C)C1CCC(CC1=O)(C)C
STK968552
Synonyms: 5-bromo-3-methyl-6-[(naphthalen-1-yloxy)methyl]imidazo[2,1-b][1,3]thiazole
Smiles: Cc1csc2n1c(Br)c(n2)COc1cccc2c1cccc2
STK968554
Synonyms: 3-[(4-butoxy-3-nitrobenzyl)sulfanyl]-5-(4-methoxyphenyl)-4H-1,2,4-triazole
Smiles: CCCCOc1ccc(cc1[N+](=O)[O-])CSc1nnc([nH]1)c1ccc(cc1)OC
STK968555
Synonyms: 7-[4-(methylsulfanyl)phenyl]-5-(thiophen-2-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Smiles: CSc1ccc(cc1)C1C=C(Nc2n1ncn2)c1cccs1
STK968556
Synonyms: ethyl2-[2-(benzylamino)-2-oxoethyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(CC(=O)NCc2ccccc2)sc2c1CCC2
STK968557
Synonyms: 1-[5-(4-ethoxyphenyl)pyrimidin-4-yl]-3-phenylthiourea
Smiles: CCOc1ccc(cc1)c1cncnc1NC(=S)Nc1ccccc1
STK968558
Synonyms: N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-N~2~,N~2~-diethylglycinamide
Smiles: CCN(CC(=O)NCC1OCCc2c1cccc2)CC
STK968559
Synonyms: 3-{[(4-chlorophenyl)acetyl]amino}-3-(4-fluorophenyl)propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)F)NC(=O)Cc1ccc(cc1)Cl
STK968560
Synonyms: 2-[(4-benzyl-5-heptyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Smiles: CCCCCCCc1nnc(n1Cc1ccccc1)SCC(=O)N
STK968561
Synonyms: 1-benzyl-5-[(4-fluorobenzyl)sulfanyl]-2-methyl-4-nitro-1H-imidazole
Smiles: Fc1ccc(cc1)CSc1c(nc(n1Cc1ccccc1)C)[N+](=O)[O-]
STK968562
Synonyms: 2-methyl-4-nitro-5-(pentylsulfanyl)-1H-imidazole
Smiles: CCCCCSc1[nH]c(nc1[N+](=O)[O-])C
STK968564
Synonyms: 11-methyl-5-(pyrrolidin-1-yl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CC1CCCc2c1c1c(s2)nc(n2c1ncn2)N1CCCC1
STK968565
Synonyms: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1H-benzimidazole
Smiles: O=S(=O)(n1cnc2c1cccc2)c1ccc2c(c1)OCCO2
STK968566
Synonyms: 1,1-dibutyl-3-(3'-cyano-1'H-spiro[cyclopentane-1,2'-naphthalen]-4'-yl)urea
Smiles: CCCCN(C(=O)NC1=C(C#N)C2(Cc3c1cccc3)CCCC2)CCCC
STK968568
Synonyms: 5-fluoro-N-(2-hydroxyphenyl)-2-methoxybenzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)Nc1ccccc1O)F
STK968569
Synonyms: N-(3-acetylphenyl)-2-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide
Smiles: O=C(Nc1cccc(c1)C(=O)C)CC1CCS(=O)(=O)C1
STK968570
Synonyms: 3-({3-carbamoyl-5-methyl-4-[4-(propan-2-yl)phenyl]thiophen-2-yl}carbamoyl)bicyclo[2.2.1]hept-5-ene-2-carboxylicacid
Smiles: O=C(C1C2C=CC(C1C(=O)O)C2)Nc1sc(c(c1C(=O)N)c1ccc(cc1)C(C)C)C
STK968571
Synonyms: 5-(1,3-dimethyl-1H-pyrazol-4-yl)-4-ethyl-4H-1,2,4-triazole-3-thiol
Smiles: CCn1c(S)nnc1c1cn(nc1C)C
STK968572
Synonyms: 2-bromo-4-[(E)-(2,5-dioxo-3-phenylimidazolidin-4-ylidene)methyl]-6-methoxyphenylacetate
Smiles: COc1cc(cc(c1OC(=O)C)Br)/C=C/1\C(=O)NC(=O)N1c1ccccc1
STK968573
Synonyms: 3-[(1-ethyl-1H-benzimidazol-2-yl)amino]-1-(naphthalen-1-yl)pyrrolidine-2,5-dione
Smiles: CCn1c(NC2CC(=O)N(C2=O)c2cccc3c2cccc3)nc2c1cccc2
STK968574
Synonyms: 2-bromo-N-[(1Z)-3-oxo-3-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)-1-(thiophen-2-yl)prop-1-en-2-yl]benzamide
Smiles: O=C(/C(=C/c1cccs1)/NC(=O)c1ccccc1Br)N1CC2CC(C1)c1n(C2)c(=O)ccc1
STK968575
Synonyms: N'-[(E)-(5-bromo-2-methoxyphenyl)methylidene]-2-(3,4-dimethoxyphenyl)quinoline-4-carbohydrazide
Smiles: COc1cc(ccc1OC)c1nc2ccccc2c(c1)C(=O)N/N=C/c1cc(Br)ccc1OC
STK968576
Synonyms: N-(4-methylphenyl)-2-(tricyclo[3.3.1.1~3,7~]dec-1-ylacetyl)hydrazinecarboxamide
Smiles: O=C(Nc1ccc(cc1)C)NNC(=O)CC12CC3CC(C2)CC(C1)C3
STK968577
Synonyms: 1-benzyl-1-(2-phenylethyl)-3-(tetrahydrofuran-2-ylmethyl)thiourea
Smiles: S=C(N(Cc1ccccc1)CCc1ccccc1)NCC1CCCO1
STK968578
Synonyms: dimethyl2-{[(4-bromo-1,5-dimethyl-1H-pyrazol-3-yl)carbonyl]amino}benzene-1,4-dicarboxylate
Smiles: COC(=O)c1ccc(cc1NC(=O)c1nn(c(c1Br)C)C)C(=O)OC
STK968581
Synonyms: 4-ethyl-5-methoxy-2-[2-methyl-5-(2-methyl-1,3-thiazol-4-yl)-6-(trifluoromethyl)pyrimidin-4-yl]phenol
Smiles: CCc1cc(c(cc1OC)O)c1nc(C)nc(c1c1csc(n1)C)C(F)(F)F
STK968582
Synonyms: 9-oxo-N-(2,4,5-trichlorophenyl)bicyclo[3.3.1]nonane-3-carboxamide
Smiles: O=C(C1CC2CCCC(C1)C2=O)Nc1cc(Cl)c(cc1Cl)Cl
STK968583
Synonyms: 2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-amine
Smiles: Clc1ccc(cc1)c1nc2n(c1N)cccc2
STK968584
Synonyms: N-(diethylcarbamothioyl)-2-phenylquinoline-4-carboxamide
Smiles: CCN(C(=S)NC(=O)c1cc(nc2c1cccc2)c1ccccc1)CC
STK968586
Synonyms: dimethyl5-{[(4-bromo-1-methyl-1H-pyrazol-3-yl)carbonyl]amino}-3-methylthiophene-2,4-dicarboxylate
Smiles: COC(=O)c1c(NC(=O)c2nn(cc2Br)C)sc(c1C)C(=O)OC
STK968587
Synonyms: ethyl(2E)-2-(furan-3-ylmethylidene)-5-(4-hydroxyphenyl)-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(C1c1ccc(cc1)O)c(=O)/c(=C\c1cocc1)/s2
STK968588
Synonyms: ethyl4-(3-methoxy-4-{[3-(trifluoromethyl)benzyl]oxy}phenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)OCc1cccc(c1)C(F)(F)F)C(=O)CCC2
STK968589
Synonyms: 1-(4-chlorophenoxy)-3-[(1-phenylethyl)amino]propan-2-ol
Smiles: OC(COc1ccc(cc1)Cl)CNC(c1ccccc1)C
STK968590
Synonyms: 2-(piperidin-1-yl)ethyl5-{[4-(propan-2-yl)phenoxy]methyl}furan-2-carboxylate
Smiles: CC(c1ccc(cc1)OCc1ccc(o1)C(=O)OCCN1CCCCC1)C
STK968591
Synonyms: 4-bromo-N-(3-cyano-4,5-dimethylthiophen-2-yl)-1-ethyl-1H-pyrazole-5-carboxamide
Smiles: CCn1ncc(c1C(=O)Nc1sc(c(c1C#N)C)C)Br
STK968595
Synonyms: (2E)-3-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-1-phenylprop-2-en-1-one
Smiles: CCn1ncc(c1C)/C=C/C(=O)c1ccccc1
STK968596
Synonyms: 3a,6a-dimethyl-2-nitrohexahydro-1,4-methanocyclopenta[c]pyrrole-1(2H)-carbonitrile
Smiles: N#CC12CC3C(C2(C)CC3)(CN1[N+](=O)[O-])C
STK968597
Synonyms: 4-(4-bromophenyl)-4-hydroxy-6-phenyl-5-(trifluoroacetyl)tetrahydropyrimidin-2(1H)-one
Smiles: O=C1NC(c2ccccc2)C(C(N1)(O)c1ccc(cc1)Br)C(=O)C(F)(F)F
STK968600
Synonyms: 4-[(2E)-2-(2-hydroxy-5-methoxybenzylidene)hydrazinyl]-N-(3-nitrophenyl)-4-oxobutanamide
Smiles: COc1ccc(c(c1)/C=N/NC(=O)CCC(=O)Nc1cccc(c1)[N+](=O)[O-])O
STK968601
Synonyms: 1-[1-(2,6-dichlorophenyl)-2,5-dioxopyrrolidin-3-yl]-1-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-3-(4-methylphenyl)thiourea
Smiles: Cc1ccc(cc1)NC(=S)N(C1CC(=O)N(C1=O)c1c(Cl)cccc1Cl)Cc1cn(nc1C)C
STK968603
Synonyms: 3-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-N-{1-[2-(diethylamino)ethyl]-1H-benzimidazol-2-yl}benzamide
Smiles: CCN(CCn1c(NC(=O)c2cccc(c2)Cn2cc(c(n2)[N+](=O)[O-])Br)nc2c1cccc2)CC
STK968604
Synonyms: dimethyl3-methyl-5-[(tricyclo[3.3.1.1~3,7~]dec-1-ylacetyl)amino]thiophene-2,4-dicarboxylate
Smiles: COC(=O)c1c(NC(=O)CC23CC4CC(C3)CC(C2)C4)sc(c1C)C(=O)OC
STK968607
Synonyms: N-methyl-4-(phenylsulfonyl)-2-propyl-1,3-oxazol-5-amine
Smiles: CCCc1oc(c(n1)S(=O)(=O)c1ccccc1)NC
STK968608
Synonyms: N-[1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-4-chloro-1-methyl-1H-pyrazole-3-carboxamide
Smiles: Brc1ccc(cc1)Cn1nc(c(c1C)NC(=O)c1nn(cc1Cl)C)C
STK968609
Synonyms: {5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-yl}(piperidin-1-yl)methanone
Smiles: O=C(c1ccc(o1)Cn1nc(c(c1C)Br)C)N1CCCCC1
STK968610
Synonyms: 2-methyl-5-oxo-N-(pyridin-2-yl)-4-(2,3,4-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: COc1ccc(c(c1OC)OC)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)Nc1ccccn1
STK968611
Synonyms: 2-amino-4-{5-[(4-bromophenoxy)methyl]furan-2-yl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1ccc(o1)COc1ccc(cc1)Br)CCCC2
STK968612
Synonyms: N-[(2-bromo-4-methylphenyl)carbamothioyl]-4-chloro-1-ethyl-1H-pyrazole-5-carboxamide
Smiles: CCn1ncc(c1C(=O)NC(=S)Nc1ccc(cc1Br)C)Cl
STK968613
Synonyms: 4-[2-(benzylsulfanyl)-6-(butanoylamino)-3,5-dicyanopyridin-4-yl]phenylbutanoate
Smiles: CCCC(=O)Nc1nc(SCc2ccccc2)c(c(c1C#N)c1ccc(cc1)OC(=O)CCC)C#N
STK968614
Synonyms: 4-[(2E)-2-(3-bromobenzylidene)hydrazinyl]-N-(3-nitrophenyl)-4-oxobutanamide
Smiles: O=C(CCC(=O)Nc1cccc(c1)[N+](=O)[O-])N/N=C/c1cccc(c1)Br
STK968615
Synonyms: (5-bromo-2,3,4-trimethylphenyl)[4-(3-chlorophenyl)piperazin-1-yl]methanone
Smiles: Clc1cccc(c1)N1CCN(CC1)C(=O)c1cc(Br)c(c(c1C)C)C
STK968616
Synonyms: N-(4-bromophenyl)-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide
Smiles: Brc1ccc(cc1)NC(=O)C12CCC(C2(C)C)(C(=O)C1)C
STK968617
Synonyms: 2-[(4-chloro-2-methylphenyl)amino]-N'-(2-methylcyclohexylidene)butanehydrazide
Smiles: CCC(C(=O)N/N=C/1\CCCCC1C)Nc1ccc(cc1C)Cl
STK968618
Synonyms: 2-(5-methylfuran-2-yl)-N-(1H-tetrazol-5-yl)quinoline-4-carboxamide
Smiles: Cc1ccc(o1)c1nc2ccccc2c(c1)C(=O)Nc1nnn[nH]1
STK968619
Synonyms: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(2,3,5,6-tetrafluorophenoxy)ethanone
Smiles: O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)COc1c(F)c(F)cc(c1F)F
STK968620
Synonyms: 4-[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-N-(2-bromophenyl)-4-oxobutanamide
Smiles: O=C(CCC(=O)Nc1ccccc1Br)N/N=C/c1ccc2c(c1)OCO2
STK968621
Synonyms: 4-bromo-N-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-spiro[2-aza-4,7-methanoisoindole-8,1'-cyclopropan]-2-yl)-1,5-dimethyl-1H-pyrazole-3-carboxamide
Smiles: O=C1N(NC(=O)c2nn(c(c2Br)C)C)C(=O)C2C1C1C=CC2C21CC2
STK968623
Synonyms: (2Z)-2-(1,3-benzoxazol-2-yl)-3-(4-hydroxyphenyl)-1-(pyridin-3-yl)prop-2-en-1-one
Smiles: Oc1ccc(cc1)/C=C(\C(=O)c1cccnc1)/c1nc2c(o1)cccc2
STK968625
Synonyms: 3-oxo-2-phenyl-4-(piperidin-1-yl)butanamide
Smiles: O=C(C(c1ccccc1)C(=O)N)CN1CCCCC1
STK968626
Synonyms: 4-bromo-N-[1-(2,4-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-1,5-dimethyl-1H-pyrazole-3-carboxamide
Smiles: Clc1ccc(c(c1)Cl)Cn1nc(c(c1C)NC(=O)c1nn(c(c1Br)C)C)C
STK968628
Synonyms: 2-[(1,3-benzoxazol-2-ylsulfanyl)methyl]-3-bromo-5,7-dimethylimidazo[1,2-a]pyrimidine
Smiles: Cc1cc(C)n2c(n1)nc(c2Br)CSc1nc2c(o1)cccc2
STK968629
Synonyms: 2-[(5-{[(4-bromophenyl)amino]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-[(E)-pyridin-2-ylmethylidene]propanehydrazide
Smiles: O=C(C(Sc1nnc(n1C)CNc1ccc(cc1)Br)C)N/N=C/c1ccccn1
STK968631
Synonyms: 7-(3,4,5-trimethoxyphenyl)-5,6,6a,7-tetrahydrobenzo[b]naphtho[1,2-e][1,4]thiazepine
Smiles: COc1c(OC)cc(cc1OC)C1Sc2ccccc2N=C2C1CCc1c2cccc1
STK968632
Synonyms: prop-2-en-1-yl7-methyl-2,4-dioxo-5-[4-(trifluoromethyl)phenyl]-1,2,3,4,5,8-hexahydropyrido[2,3-d]pyrimidine-6-carboxylate
Smiles: C=CCOC(=O)C1=C(C)Nc2c(C1c1ccc(cc1)C(F)(F)F)c(=O)[nH]c(=O)[nH]2
STK968634
Synonyms: N-[(2,5-dimethylphenoxy)acetyl]-beta-alanine
Smiles: Cc1ccc(cc1OCC(=O)NCCC(=O)O)C
STK968637
Synonyms: 6-tert-butyl-8-{[(E)-naphthalen-1-ylmethylidene]amino}[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
Smiles: O=c1n(/N=C/c2cccc3c2cccc3)c2nncn2nc1C(C)(C)C
STK968643
Synonyms: 5,7-bis(4-bromophenyl)-2-methyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-7-ium
Smiles: Brc1ccc(cc1)[n+]1cc(n2c1SC(C2)C)c1ccc(cc1)Br
STK968655
Synonyms: 7-(3,4-dihydro-2H-pyrrol-5-yl)-2,5-diphenyl-5H-imidazo[1,2-b]pyrazol-6-ol
Smiles: Oc1c(C2=NCCC2)c2n(n1c1ccccc1)cc(n2)c1ccccc1
STK968660
Synonyms: 9-{2-[2-(difluoromethoxy)phenyl]-2-oxoethyl}-3-methyl-3,9-dihydro-1H-purine-2,6-dione
Smiles: FC(Oc1ccccc1C(=O)Cn1cnc2c1n(C)c(=O)[nH]c2=O)F
STK968662
Synonyms: N-(4-bromophenyl)-2H-1,4-benzothiazin-3-amine
Smiles: Brc1ccc(cc1)NC1=Nc2c(SC1)cccc2
STK968665
Synonyms: (2Z)-2-(4-nitrobenzylidene)-2,5,6,7,8,9-hexahydro-3H-imidazo[1,2-a]azepin-3-one
Smiles: O=C1/C(=C/c2ccc(cc2)[N+](=O)[O-])/N=C2N1CCCCC2
STK968666
Synonyms: (2E)-2-(2-nitrobenzylidene)-2,5,6,7,8,9-hexahydro-3H-imidazo[1,2-a]azepin-3-one
Smiles: O=C1/C(=C\c2ccccc2[N+](=O)[O-])/N=C2N1CCCCC2
STK968681
Synonyms: 4-[(E)-{2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]hydrazinylidene}methyl]phenol
Smiles: COc1ccc(cc1)c1csc(n1)N/N=C/c1ccc(cc1)O
STK968687
Synonyms: 1-[(2Z)-3-[2-(3,4-dimethoxyphenyl)ethyl]-4-methyl-2-(phenylimino)-2,3-dihydro-1,3-thiazol-5-yl]ethanone
Smiles: COc1cc(ccc1OC)CCn1/c(=N/c2ccccc2)/sc(c1C)C(=O)C
STK968688
Synonyms: (2E)-2-(2,4-dimethoxybenzylidene)-2,5,6,7,8,9-hexahydro-3H-imidazo[1,2-a]azepin-3-one
Smiles: COc1ccc(c(c1)OC)/C=C\1/N=C2N(C1=O)CCCCC2
STK968695
Synonyms: S-benzyl-N-[(4-methylphenyl)sulfonyl]-L-cysteine
Smiles: OC(=O)[C@@H](NS(=O)(=O)c1ccc(cc1)C)CSCc1ccccc1
STK968696
Synonyms: 2-{[(3-bromoimidazo[1,2-a]pyridin-2-yl)methyl]sulfanyl}-1,3-benzoxazole
Smiles: Brc1c(CSc2nc3c(o2)cccc3)nc2n1cccc2
STK968697
Synonyms: propyl(4-iodophenyl)carbamate
Smiles: CCCOC(=O)Nc1ccc(cc1)I
STK968698
Synonyms: 4-phenoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
Smiles: O=C(c1ccc(cc1)Oc1ccccc1)Nc1scc(n1)c1ccccc1
STK968699
Synonyms: N-(6-methoxy-1,3-benzothiazol-2-yl)-4-phenoxybenzamide
Smiles: COc1ccc2c(c1)sc(n2)NC(=O)c1ccc(cc1)Oc1ccccc1
STK968700
Synonyms: N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-5-nitrothiophene-2-carboxamide
Smiles: Fc1ccc(cc1)c1csc(n1)NC(=O)c1ccc(s1)[N+](=O)[O-]
STK968701
Synonyms: 4-[(2,6-dimethylmorpholin-4-yl)sulfonyl]-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]benzamide
Smiles: CC1OC(C)CN(C1)S(=O)(=O)c1ccc(cc1)C(=O)Nc1scc(n1)c1cccc(c1)[N+](=O)[O-]
STK968702
Synonyms: ethyl{2-[(2Z)-2-(3-chlorobenzylidene)hydrazinyl]-1,3-thiazol-4-yl}acetate
Smiles: CCOC(=O)Cc1csc(n1)N/N=C\c1cccc(c1)Cl
STK968703
Synonyms: ethyl{2-[(2Z)-2-(3-bromobenzylidene)hydrazinyl]-1,3-thiazol-4-yl}acetate
Smiles: CCOC(=O)Cc1csc(n1)N/N=C\c1cccc(c1)Br
STK968704
Synonyms: 3-(2-bromophenoxy)-7-hydroxy-8-[(4-methylpiperazin-1-yl)methyl]-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: CN1CCN(CC1)Cc1c(O)ccc2c1oc(c(c2=O)Oc1ccccc1Br)C(F)(F)F
STK968705
Synonyms: 4-(dimethylsulfamoyl)-N-{4-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl}benzamide
Smiles: CCc1nnc(s1)NS(=O)(=O)c1ccc(cc1)NC(=O)c1ccc(cc1)S(=O)(=O)N(C)C
STK968706
Synonyms: 8-chloro-2-methyl-3-[(2-methylpiperidin-1-yl)methyl]quinolin-4-ol
Smiles: CC1CCCCN1Cc1c(C)nc2c(c1O)cccc2Cl
STK968707
Synonyms: 2-methoxy-4-[(E)-2-nitroethenyl]phenyl2-bromobenzoate
Smiles: COc1cc(ccc1OC(=O)c1ccccc1Br)/C=C/[N+](=O)[O-]
STK968708
Synonyms: N'-(6-bromoquinazolin-4-yl)-N,N-dimethylethane-1,2-diamine
Smiles: CN(CCNc1ncnc2c1cc(Br)cc2)C
STK968709
Synonyms: ethyl2-({(2E)-3-[3-methoxy-4-(pentyloxy)phenyl]prop-2-enoyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCCCCOc1ccc(cc1OC)/C=C/C(=O)Nc1sc2c(c1C(=O)OCC)CCC(C2)C
STK968710
Synonyms: N'-(2-chlorobenzylidene)-2-(3-methylphenoxy)propanehydrazide
Smiles: Cc1cccc(c1)OC(C(=O)N/N=C\c1ccccc1Cl)C
STK968711
Synonyms: N'-(4-chlorobenzylidene)-2-(3-methylphenoxy)propanehydrazide
Smiles: O=C(C(Oc1cccc(c1)C)C)N/N=C\c1ccc(cc1)Cl
STK968712
Synonyms: 2-(3-methylphenoxy)-N'-[4-(propan-2-yl)benzylidene]propanehydrazide
Smiles: O=C(C(Oc1cccc(c1)C)C)N/N=C\c1ccc(cc1)C(C)C
STK968713
Synonyms: N'-(4-ethoxybenzylidene)-2-(3-methylphenoxy)propanehydrazide
Smiles: CCOc1ccc(cc1)/C=N\NC(=O)C(Oc1cccc(c1)C)C
STK968714
Synonyms: biphenyl-4-yl2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-methylpentanoate
Smiles: CC(CC(N1C(=O)c2c(C1=O)cccc2)C(=O)Oc1ccc(cc1)c1ccccc1)C
STK968715
Synonyms: 6-bromo-4-(4-methylpiperazin-1-yl)quinazoline
Smiles: CN1CCN(CC1)c1ncnc2c1cc(Br)cc2
STK968716
Synonyms: 2-methyl-3-[5-(pyridinium-1-yl)pentyl]-1,3-benzothiazol-3-ium
Smiles: Cc1sc2c([n+]1CCCCC[n+]1ccccc1)cccc2
STK968717
Synonyms: 3-(2-bromophenoxy)-8-[(dimethylamino)methyl]-7-hydroxy-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: CN(Cc1c(O)ccc2c1oc(c(c2=O)Oc1ccccc1Br)C(F)(F)F)C
STK968718
Synonyms: 8H-quinazolino[4,3-b]quinazolin-8-one
Smiles: O=c1c2ccccc2nc2n1cnc1c2cccc1
STK968719
Synonyms: diethyl5-[(cyclopropylcarbonyl)amino]-3-methylthiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1sc(c(c1C)C(=O)OCC)NC(=O)C1CC1
STK968720
Synonyms: N-(2,5-dimethylphenyl)-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)acetamide
Smiles: O=C(Nc1cc(C)ccc1C)CSc1nnc2n1cccc2
STK968721
Synonyms: 4-methyl-2-oxo-2H-chromen-7-yl2,3,6-trichlorobenzoate
Smiles: O=c1cc(C)c2c(o1)cc(cc2)OC(=O)c1c(Cl)ccc(c1Cl)Cl
STK968722
Synonyms: dimethyl2-{[(2-methylphenyl)carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
Smiles: COC(=O)C1CCc2c1c(C(=O)OC)c(s2)NC(=O)c1ccccc1C
STK968723
Synonyms: dimethyl2-{[(2,4-dibromophenoxy)acetyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
Smiles: COC(=O)c1c(NC(=O)COc2ccc(cc2Br)Br)sc2c1C(CC2)C(=O)OC
STK968724
Synonyms: 2-[(5Z)-5-(4-chlorobenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]acetamide
Smiles: O=C(CN1C(=O)S/C(=C\c2ccc(cc2)Cl)/C1=O)Nc1ccc(cc1)S(=O)(=O)Nc1nccs1
STK968725
Synonyms: 4-(methylsulfanyl)-2-(4-oxo-2-thioxo-1,3-thiazolidin-3-yl)butanoicacid
Smiles: CSCCC(N1C(=S)SCC1=O)C(=O)O
STK968726
Synonyms: (5E)-5-(4-chlorobenzylidene)-3-(3-hydroxyphenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: Clc1ccc(cc1)/C=C\1/SC(=S)N(C1=O)c1cccc(c1)O
STK968727
Synonyms: diethyl[(4-chlorophenyl)sulfonyl][(E)-(4-methylphenyl)diazenyl]propanedioate
Smiles: CCOC(=O)C(S(=O)(=O)c1ccc(cc1)Cl)(C(=O)OCC)/N=N/c1ccc(cc1)C
STK968728
Synonyms: [2-(1,3-benzodioxol-5-yl)hydrazinylidene]propanedinitrile
Smiles: N#CC(=NNc1ccc2c(c1)OCO2)C#N
STK968729
Synonyms: N,N'-bis(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethanediamide
Smiles: O=C(C(=O)Nc1sc2c(c1C(=O)N)CCCC2)Nc1sc2c(c1C(=O)N)CCCC2
STK968732
Synonyms: propyl3-({[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl}amino)benzoate
Smiles: CCCOC(=O)c1cccc(c1)NC(=O)c1c(C)onc1c1ccccc1Cl
STK968733
Synonyms: 6-bromo-N-(2-ethyl-6-methylphenyl)-2-oxo-2H-chromene-3-carboxamide
Smiles: CCc1cccc(c1NC(=O)c1cc2cc(Br)ccc2oc1=O)C
STK968734
Synonyms: propyl3-{[(6-bromo-2-oxo-2H-chromen-3-yl)carbonyl]amino}benzoate
Smiles: CCCOC(=O)c1cccc(c1)NC(=O)c1cc2cc(Br)ccc2oc1=O
STK968735
Synonyms: 4-(2,6-dimethylmorpholin-4-yl)-5-phenylthieno[2,3-d]pyrimidine
Smiles: CC1OC(C)CN(C1)c1ncnc2c1c(cs2)c1ccccc1
STK968736
Synonyms: 4-(4-benzylpiperazin-1-yl)-5-phenylthieno[2,3-d]pyrimidine
Smiles: c1ccc(cc1)CN1CCN(CC1)c1ncnc2c1c(cs2)c1ccccc1
STK968737
Synonyms: 2-ethoxyethyl3-{[(2-tert-butylphenoxy)acetyl]amino}benzoate
Smiles: CCOCCOC(=O)c1cccc(c1)NC(=O)COc1ccccc1C(C)(C)C
STK968738
Synonyms: ethyl4-(3,4-dimethylphenyl)-2-(2,5-dimethyl-1H-pyrrol-1-yl)thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(csc1n1c(C)ccc1C)c1ccc(c(c1)C)C
STK968739
Synonyms: 5-(4-fluorophenyl)-N-[2-(thiophen-2-yl)ethyl]thieno[2,3-d]pyrimidin-4-amine
Smiles: Fc1ccc(cc1)c1csc2c1c(NCCc1cccs1)ncn2
STK968740
Synonyms: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-amine
Smiles: Fc1ccc(cc1)c1csc2c1c(NCCc1ccc3c(c1)OCCO3)ncn2
STK968741
Synonyms: 2-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}-3-(prop-2-en-1-yl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: C=CCn1c(SCc2c(C)noc2C)nc2c(c1=O)c1CCCc1s2
STK968742
Synonyms: N-[4-(acetylamino)phenyl]-2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-ylsulfanyl)acetamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)CSc1nnc2n1c1ccccc1s2
STK968743
Synonyms: 4-(1,3-benzoxazol-2-ylsulfanyl)-2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: Cc1nc(Sc2nc3c(o2)cccc3)c2c(n1)sc1c2CCCC1