Product OPENEYE NAME: [4-bromo-2-[[[2-(2-methoxyphenoxy)acetyl]hydrazono]methyl]phenyl] 2-methylbenzoate
CAS Name: 2-methylbenzoic acid [4-bromo-2-[[[2-(2-methoxyphenoxy)-1-oxoethyl]hydrazinylidene]methyl]phenyl] ester
IUPAC NAME: [4-bromo-2-[[[2-(2-methoxyphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 2-methylbenzoate
SYSTEMATIC NAME: [4-bromanyl-2-[[2-(2-methoxyphenoxy)ethanoylhydrazinylidene]methyl]phenyl] 2-methylbenzoate
MOLECULAR FORMULA: C24H21BrN2O5
MOLECULAR WEIGHT: 497.33794
SMILES: CC1=CC=CC=C1C(=O)OC2=C(C=C(C=C2)Br)C=NNC(=O)COC3=CC=CC=C3OC
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MOLECULAR FORMULA: C16H19N3O3
MOLECULAR WEIGHT: 301.34036
SMILES: CCOC(=O)C1=CN=C2C=C3C(=CN2C1=O)CCCCN3C
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Product OPENEYE NAME: N-[2-[2-[(4-benzyloxyphenyl)methylene]hydrazino]-2-oxo-ethyl]-4-butoxy-benzamide
CAS Name: 4-butoxy-N-[2-oxo-2-[2-[(4-phenylmethoxyphenyl)methylidene]hydrazinyl]ethyl]benzamide
IUPAC NAME: 4-butoxy-N-[2-oxo-2-[2-[(4-phenylmethoxyphenyl)methylidene]hydrazinyl]ethyl]benzamide
SYSTEMATIC NAME: 4-butoxy-N-[2-oxidanylidene-2-[2-[(4-phenylmethoxyphenyl)methylidene]hydrazinyl]ethyl]benzamide
MOLECULAR FORMULA: C27H29N3O4
MOLECULAR WEIGHT: 459.53686
SMILES: CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)NN=CC2=CC=C(C=C2)OCC3=CC=CC=C3
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Product OPENEYE NAME: N-[2-oxo-2-[2-(4-pyridylmethylene)hydrazino]ethyl]dodecanamide
CAS Name: N-[2-oxo-2-[2-(pyridin-4-ylmethylidene)hydrazinyl]ethyl]dodecanamide
IUPAC NAME: N-[2-oxo-2-[2-(pyridin-4-ylmethylidene)hydrazinyl]ethyl]dodecanamide
SYSTEMATIC NAME: N-[2-oxidanylidene-2-[2-(pyridin-4-ylmethylidene)hydrazinyl]ethyl]dodecanamide
MOLECULAR FORMULA: C20H32N4O2
MOLECULAR WEIGHT: 360.49368
SMILES: CCCCCCCCCCCC(=O)NCC(=O)NN=CC1=CC=NC=C1
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Product OPENEYE NAME: 1-hexa-2,5-dienoxy-3,6,8-tris(methoxymethoxy)anthracene-9,10-dione
CAS Name: 1-hexa-2,5-dienoxy-3,6,8-tris(methoxymethoxy)anthracene-9,10-dione
IUPAC NAME: 1-hexa-2,5-dienoxy-3,6,8-tris(methoxymethoxy)anthracene-9,10-dione
SYSTEMATIC NAME: 1-hexa-2,5-dienoxy-3,6,8-tris(methoxymethoxy)anthracene-9,10-dione
MOLECULAR FORMULA: C26H28O9
MOLECULAR WEIGHT: 484.49512
SMILES: COCOC1=CC(=C2C(=C1)C(=O)C3=CC(=CC(=C3C2=O)OCOC)OCOC)OCC=CCC=C
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Product OPENEYE NAME: 6-fluoro-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
CAS Name: 6-fluoro-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
IUPAC NAME: 6-fluoro-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
SYSTEMATIC NAME: 6-fluoranyl-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
MOLECULAR FORMULA: C19H27FO
MOLECULAR WEIGHT: 290.415483
SMILES: CC12CCCCC1=C(CC3C2CCC4(C3CCC4=O)C)F
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Product OPENEYE NAME: 10,13-dimethyl-17-(1,4,5-trimethylhex-2-enyl)-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene
CAS Name: 17-(5,6-dimethylhept-3-en-2-yl)-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene
IUPAC NAME: 17-(5,6-dimethylhept-3-en-2-yl)-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene
SYSTEMATIC NAME: 17-(5,6-dimethylhept-3-en-2-yl)-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene
MOLECULAR FORMULA: C28H46
MOLECULAR WEIGHT: 382.66484
SMILES: CC(C)C(C)C=CC(C)C1CCC2C1(CCC3C2=CCC4C3(CCCC4)C)C
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Product OPENEYE NAME: 2,6-ditert-butyl-4-(5-chloro-2-thienyl)pyrylium
CAS Name: 2,6-ditert-butyl-4-(5-chloro-2-thiophenyl)pyrylium
IUPAC NAME: 2,6-ditert-butyl-4-(5-chlorothiophen-2-yl)pyrylium
SYSTEMATIC NAME: 2,6-ditert-butyl-4-(5-chloranylthiophen-2-yl)pyrylium
MOLECULAR FORMULA: C17H22ClOS+
MOLECULAR WEIGHT: 309.87398
SMILES: CC(C)(C)C1=CC(=CC(=[O+]1)C(C)(C)C)C2=CC=C(S2)Cl
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MOLECULAR FORMULA: C26H31N3O4S
MOLECULAR WEIGHT: 481.60704
SMILES: CSC1=CC=CC(=C1)NC(=O)C2C3C=CC4(C2C(=O)N(C4C(=O)NC5CCCCC5)CC=C)O3
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Product OPENEYE NAME: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-(2-thienyl)acetamide
CAS Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-thiophen-2-ylacetamide
IUPAC NAME: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-thiophen-2-ylacetamide
SYSTEMATIC NAME: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-thiophen-2-yl-ethanamide
MOLECULAR FORMULA: C18H21N3OS2
MOLECULAR WEIGHT: 359.50884
SMILES: C1C2CC3CC1CC(C2)(C3)C4=NN=C(S4)NC(=O)CC5=CC=CS5
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Product OPENEYE NAME: [1-[(4-fluorophenoxy)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-(4-methyl-3-nitro-phenyl)methanone
CAS Name: [1-[(4-fluorophenoxy)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-(4-methyl-3-nitrophenyl)methanone
IUPAC NAME: [1-[(4-fluorophenoxy)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-(4-methyl-3-nitrophenyl)methanone
SYSTEMATIC NAME: [1-[(4-fluoranylphenoxy)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-(4-methyl-3-nitro-phenyl)methanone
MOLECULAR FORMULA: C26H25FN2O6
MOLECULAR WEIGHT: 480.484903
SMILES: CC1=C(C=C(C=C1)C(=O)N2CCC3=CC(=C(C=C3C2COC4=CC=C(C=C4)F)OC)OC)[N+](=O)[O-]
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Product OPENEYE NAME: N-(2-methyl-1,3-dioxo-isoindolin-5-yl)-1,3-benzothiazole-6-carboxamide
CAS Name: N-(2-methyl-1,3-dioxo-5-isoindolyl)-1,3-benzothiazole-6-carboxamide
IUPAC NAME: N-(2-methyl-1,3-dioxoisoindol-5-yl)-1,3-benzothiazole-6-carboxamide
SYSTEMATIC NAME: N-[2-methyl-1,3-bis(oxidanylidene)isoindol-5-yl]-1,3-benzothiazole-6-carboxamide
MOLECULAR FORMULA: C17H11N3O3S
MOLECULAR WEIGHT: 337.35254
SMILES: CN1C(=O)C2=C(C1=O)C=C(C=C2)NC(=O)C3=CC4=C(C=C3)N=CS4
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Product OPENEYE NAME: N-(4-bromophenyl)-2,3-dioxo-1,4-dihydroquinoxaline-6-sulfonamide
CAS Name: N-(4-bromophenyl)-2,3-dioxo-1,4-dihydroquinoxaline-6-sulfonamide
IUPAC NAME: N-(4-bromophenyl)-2,3-dioxo-1,4-dihydroquinoxaline-6-sulfonamide
SYSTEMATIC NAME: N-(4-bromophenyl)-2,3-bis(oxidanylidene)-1,4-dihydroquinoxaline-6-sulfonamide
MOLECULAR FORMULA: C14H10BrN3O4S
MOLECULAR WEIGHT: 396.2159
SMILES: C1=CC(=CC=C1NS(=O)(=O)C2=CC3=C(C=C2)NC(=O)C(=O)N3)Br
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Product OPENEYE NAME: 1-(4-chlorophenyl)-N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]cyclopentanecarboxamide
CAS Name: 1-(4-chlorophenyl)-N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-1-cyclopentanecarboxamide
IUPAC NAME: 1-(4-chlorophenyl)-N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]cyclopentane-1-carboxamide
SYSTEMATIC NAME: 1-(4-chlorophenyl)-N-[2-(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)ethyl]cyclopentane-1-carboxamide
MOLECULAR FORMULA: C25H27ClN2O2
MOLECULAR WEIGHT: 422.94708
SMILES: CC1=C(C=C2C(=C1)C=C(C(=O)N2)CCNC(=O)C3(CCCC3)C4=CC=C(C=C4)Cl)C
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Product OPENEYE NAME: 3-(2-oxo-1,3-benzoxazol-3-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
CAS Name: 3-(2-oxo-1,3-benzoxazol-3-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
IUPAC NAME: 3-(2-oxo-1,3-benzoxazol-3-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
SYSTEMATIC NAME: 3-(2-oxidanylidene-1,3-benzoxazol-3-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
MOLECULAR FORMULA: C18H19N3O5S
MOLECULAR WEIGHT: 389.42556
SMILES: C1=CC=C2C(=C1)N(C(=O)O2)CCC(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N
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Product OPENEYE NAME: 2-[4-(4-fluorophenyl)thiazol-2-yl]-3-(o-tolyl)prop-2-enenitrile
CAS Name: 2-[4-(4-fluorophenyl)-2-thiazolyl]-3-(2-methylphenyl)-2-propenenitrile
IUPAC NAME: 2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-(2-methylphenyl)prop-2-enenitrile
SYSTEMATIC NAME: 2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-(2-methylphenyl)prop-2-enenitrile
MOLECULAR FORMULA: C19H13FN2S
MOLECULAR WEIGHT: 320.383323
SMILES: CC1=CC=CC=C1C=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)F
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Product OPENEYE NAME: N-[[4-(2,3-dimethylphenyl)-5-[2-(4-fluoroanilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-(dimethylsulfamoyl)benzamide
CAS Name: N-[[4-(2,3-dimethylphenyl)-5-[[2-(4-fluoroanilino)-2-oxoethyl]thio]-1,2,4-triazol-3-yl]methyl]-4-(dimethylsulfamoyl)benzamide
IUPAC NAME: N-[[4-(2,3-dimethylphenyl)-5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-(dimethylsulfamoyl)benzamide
SYSTEMATIC NAME: N-[[4-(2,3-dimethylphenyl)-5-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-(dimethylsulfamoyl)benzamide
MOLECULAR FORMULA: C28H29FN6O4S2
MOLECULAR WEIGHT: 596.696063
SMILES: CC1=C(C(=CC=C1)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)F)CNC(=O)C4=CC=C(C=C4)S(=O)(=O)N(C)C)C
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Product OPENEYE NAME: 5,7-bis(ethylamino)-2-(morpholinomethyl)-[1,2,4]triazolo[4,3-a][1,3,5]triazine-3-thione
CAS Name: 5,7-bis(ethylamino)-2-(4-morpholinylmethyl)-[1,2,4]triazolo[4,3-a][1,3,5]triazine-3-thione
IUPAC NAME: 5,7-bis(ethylamino)-2-(morpholin-4-ylmethyl)-[1,2,4]triazolo[4,3-a][1,3,5]triazine-3-thione
SYSTEMATIC NAME: 5,7-bis(ethylamino)-2-(morpholin-4-ylmethyl)-[1,2,4]triazolo[4,3-a][1,3,5]triazine-3-thione
MOLECULAR FORMULA: C13H22N8OS
MOLECULAR WEIGHT: 338.43178
SMILES: CCNC1=NC2=NN(C(=S)N2C(=N1)NCC)CN3CCOCC3
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Product OPENEYE NAME: N-[2-chloro-5-(trifluoromethyl)phenyl]-6-methoxy-2-oxo-chromene-3-carboxamide
CAS Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-6-methoxy-2-oxo-1-benzopyran-3-carboxamide
IUPAC NAME: N-[2-chloro-5-(trifluoromethyl)phenyl]-6-methoxy-2-oxochromene-3-carboxamide
SYSTEMATIC NAME: N-[2-chloranyl-5-(trifluoromethyl)phenyl]-6-methoxy-2-oxidanylidene-chromene-3-carboxamide
MOLECULAR FORMULA: C18H11ClF3NO4
MOLECULAR WEIGHT: 397.73245
SMILES: COC1=CC2=C(C=C1)OC(=O)C(=C2)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl
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MOLECULAR FORMULA: C27H26Cl2N4O5
MOLECULAR WEIGHT: 557.42514
SMILES: CCOC(=O)C1=CC2=C(N=C3C=CC=CN3C2=O)N(C1=NC(=O)CCOC4=C(C=C(C=C4)Cl)Cl)CC(C)C
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Product OPENEYE NAME: [2-tert-butyl-5-methyl-4-(2,3,4,5,6-pentafluorophenyl)sulfanyl-pyrazol-3-yl] 4-butoxybenzoate
CAS Name: 4-butoxybenzoic acid [2-tert-butyl-5-methyl-4-[(2,3,4,5,6-pentafluorophenyl)thio]-3-pyrazolyl] ester
IUPAC NAME: [2-tert-butyl-5-methyl-4-(2,3,4,5,6-pentafluorophenyl)sulfanylpyrazol-3-yl] 4-butoxybenzoate
SYSTEMATIC NAME: [2-tert-butyl-5-methyl-4-[2,3,4,5,6-pentakis(fluoranyl)phenyl]sulfanyl-pyrazol-3-yl] 4-butoxybenzoate
MOLECULAR FORMULA: C25H25F5N2O3S
MOLECULAR WEIGHT: 528.534616
SMILES: CCCCOC1=CC=C(C=C1)C(=O)OC2=C(C(=NN2C(C)(C)C)C)SC3=C(C(=C(C(=C3F)F)F)F)F
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Product OPENEYE NAME: 2-[(2-chlorophenyl)methylsulfanyl]-5-(4-hydroxyphenyl)-8,8-dimethyl-5,7,9,10-tetrahydro-1H-pyrimido[4,5-b]quinoline-4,6-dione
CAS Name: 2-[(2-chlorophenyl)methylthio]-5-(4-hydroxyphenyl)-8,8-dimethyl-5,7,9,10-tetrahydro-1H-pyrimido[4,5-b]quinoline-4,6-dione
IUPAC NAME: 2-[(2-chlorophenyl)methylsulfanyl]-5-(4-hydroxyphenyl)-8,8-dimethyl-5,7,9,10-tetrahydro-1H-pyrimido[4,5-b]quinoline-4,6-dione
SYSTEMATIC NAME: 2-[(2-chlorophenyl)methylsulfanyl]-5-(4-hydroxyphenyl)-8,8-dimethyl-5,7,9,10-tetrahydro-1H-pyrimido[4,5-b]quinoline-4,6-dione
MOLECULAR FORMULA: C26H24ClN3O3S
MOLECULAR WEIGHT: 494.00506
SMILES: CC1(CC2=C(C(C3=C(N2)NC(=NC3=O)SCC4=CC=CC=C4Cl)C5=CC=C(C=C5)O)C(=O)C1)C
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