Wednesday, February 29, 2012

All Chemical Compounds Information




Product OPENEYE NAME: N-benzyl-N'-[[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]methyleneamino]oxamide
CAS Name: N'-[[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]-N-(phenylmethyl)oxamide
IUPAC NAME: N-benzyl-N'-[[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]oxamide
SYSTEMATIC NAME: N'-[[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]-N-(phenylmethyl)ethanediamide
MOLECULAR FORMULA: C25H24FN3O4
MOLECULAR WEIGHT: 449.474163
SMILES: CCOC1=C(C=CC(=C1)C=NNC(=O)C(=O)NCC2=CC=CC=C2)OCC3=CC=CC=C3F
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Product OPENEYE NAME: N-[[4-[(2,4-dichlorophenyl)methoxy]phenyl]methyleneamino]-2-(4-nitropyrazol-1-yl)acetamide
CAS Name: N-[[4-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-2-(4-nitro-1-pyrazolyl)acetamide
IUPAC NAME: N-[[4-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-2-(4-nitropyrazol-1-yl)acetamide
SYSTEMATIC NAME: N-[[4-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-2-(4-nitropyrazol-1-yl)ethanamide
MOLECULAR FORMULA: C19H15Cl2N5O4
MOLECULAR WEIGHT: 448.2595
SMILES: C1=CC(=CC=C1C=NNC(=O)CN2C=C(C=N2)[N+](=O)[O-])OCC3=C(C=C(C=C3)Cl)Cl
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Product OPENEYE NAME: N'-[1-(4-benzyloxyphenyl)ethylideneamino]-N-(2,6-dimethylphenyl)oxamide
CAS Name: N-(2,6-dimethylphenyl)-N'-[1-(4-phenylmethoxyphenyl)ethylideneamino]oxamide
IUPAC NAME: N-(2,6-dimethylphenyl)-N'-[1-(4-phenylmethoxyphenyl)ethylideneamino]oxamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-N'-[1-(4-phenylmethoxyphenyl)ethylideneamino]ethanediamide
MOLECULAR FORMULA: C25H25N3O3
MOLECULAR WEIGHT: 415.4843
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C(=O)NN=C(C)C2=CC=C(C=C2)OCC3=CC=CC=C3
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Product OPENEYE NAME: methyl 2-[[2-[2-[[3-bromo-5-ethoxy-4-(1-naphthylmethoxy)phenyl]methylene]hydrazino]-2-oxo-acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
CAS Name: 2-[[2-[2-[[3-bromo-5-ethoxy-4-(1-naphthalenylmethoxy)phenyl]methylidene]hydrazinyl]-1,2-dioxoethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester
IUPAC NAME: methyl 2-[[2-[2-[[3-bromo-5-ethoxy-4-(naphthalen-1-ylmethoxy)phenyl]methylidene]hydrazinyl]-2-oxoacetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
SYSTEMATIC NAME: methyl 2-[[2-[2-[[3-bromanyl-5-ethoxy-4-(naphthalen-1-ylmethoxy)phenyl]methylidene]hydrazinyl]-2-oxidanylidene-ethanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
MOLECULAR FORMULA: C31H28BrN3O6S
MOLECULAR WEIGHT: 650.53952
SMILES: CCOC1=C(C(=CC(=C1)C=NNC(=O)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC)Br)OCC4=CC=CC5=CC=CC=C54
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Product OPENEYE NAME: 3-(4-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-1-[(3,4,5-trimethoxyphenyl)methyl]thiourea
CAS Name: 3-(4-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-1-[(3,4,5-trimethoxyphenyl)methyl]thiourea
IUPAC NAME: 3-(4-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-1-[(3,4,5-trimethoxyphenyl)methyl]thiourea
SYSTEMATIC NAME: 3-(4-chlorophenyl)-1-[(4-methoxyphenyl)methyl]-1-[(3,4,5-trimethoxyphenyl)methyl]thiourea
MOLECULAR FORMULA: C25H27ClN2O4S
MOLECULAR WEIGHT: 487.01088
SMILES: COC1=CC=C(C=C1)CN(CC2=CC(=C(C(=C2)OC)OC)OC)C(=S)NC3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 1-[[4-(dimethylamino)phenyl]methyl]-3-(4-methoxyphenyl)-1-(3-pyridylmethyl)thiourea
CAS Name: 1-[[4-(dimethylamino)phenyl]methyl]-3-(4-methoxyphenyl)-1-(3-pyridinylmethyl)thiourea
IUPAC NAME: 1-[[4-(dimethylamino)phenyl]methyl]-3-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea
SYSTEMATIC NAME: 1-[[4-(dimethylamino)phenyl]methyl]-3-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea
MOLECULAR FORMULA: C23H26N4OS
MOLECULAR WEIGHT: 406.54374
SMILES: CN(C)C1=CC=C(C=C1)CN(CC2=CN=CC=C2)C(=S)NC3=CC=C(C=C3)OC
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Product OPENEYE NAME: N-[2-methoxy-4-[3-methoxy-4-(propanoylamino)phenyl]phenyl]propanamide
CAS Name: N-[2-methoxy-4-[3-methoxy-4-(1-oxopropylamino)phenyl]phenyl]propanamide
IUPAC NAME: N-[2-methoxy-4-[3-methoxy-4-(propanoylamino)phenyl]phenyl]propanamide
SYSTEMATIC NAME: N-[2-methoxy-4-[3-methoxy-4-(propanoylamino)phenyl]phenyl]propanamide
MOLECULAR FORMULA: C20H24N2O4
MOLECULAR WEIGHT: 356.41556
SMILES: CCC(=O)NC1=C(C=C(C=C1)C2=CC(=C(C=C2)NC(=O)CC)OC)OC
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Product OPENEYE NAME: 1-(4-chlorophenyl)-1-methylsulfonyl-3-(m-tolylcarbamoyl)urea
CAS Name: 1-(4-chlorophenyl)-3-[(3-methylanilino)-oxomethyl]-1-methylsulfonylurea
IUPAC NAME: 1-(4-chlorophenyl)-3-[(3-methylphenyl)carbamoyl]-1-methylsulfonylurea
SYSTEMATIC NAME: 1-(4-chlorophenyl)-3-[(3-methylphenyl)carbamoyl]-1-methylsulfonyl-urea
MOLECULAR FORMULA: C16H16ClN3O4S
MOLECULAR WEIGHT: 381.83394
SMILES: CC1=CC(=CC=C1)NC(=O)NC(=O)N(C2=CC=C(C=C2)Cl)S(=O)(=O)C
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Product OPENEYE NAME: N-(2-methyl-1,3-dioxo-isoindolin-5-yl)-4-[methyl(phenyl)sulfamoyl]benzamide
CAS Name: N-(2-methyl-1,3-dioxo-5-isoindolyl)-4-[methyl(phenyl)sulfamoyl]benzamide
IUPAC NAME: N-(2-methyl-1,3-dioxoisoindol-5-yl)-4-[methyl(phenyl)sulfamoyl]benzamide
SYSTEMATIC NAME: N-[2-methyl-1,3-bis(oxidanylidene)isoindol-5-yl]-4-[methyl(phenyl)sulfamoyl]benzamide
MOLECULAR FORMULA: C23H19N3O5S
MOLECULAR WEIGHT: 449.47906
SMILES: CN1C(=O)C2=C(C1=O)C=C(C=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(C)C4=CC=CC=C4
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Product OPENEYE NAME: 4-(4-benzyloxyphenyl)-2-phenacylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
CAS Name: 2-(phenacylthio)-4-(4-phenylmethoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
IUPAC NAME: 2-phenacylsulfanyl-4-(4-phenylmethoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
SYSTEMATIC NAME: 2-phenacylsulfanyl-4-(4-phenylmethoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
MOLECULAR FORMULA: C31H26N2O2S
MOLECULAR WEIGHT: 490.61534
SMILES: C1CCC2=C(C1)C(=C(C(=N2)SCC(=O)C3=CC=CC=C3)C#N)C4=CC=C(C=C4)OCC5=CC=CC=C5
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Product OPENEYE NAME: 5-[(4,5-dimethylthiazol-3-ium-3-yl)methyl]-2-methyl-pyrimidin-1-ium-4-amine
CAS Name: 5-[(4,5-dimethyl-3-thiazol-3-iumyl)methyl]-2-methyl-4-pyrimidin-1-iumamine
IUPAC NAME: 5-[(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)methyl]-2-methylpyrimidin-1-ium-4-amine
SYSTEMATIC NAME: 5-[(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)methyl]-2-methyl-pyrimidin-1-ium-4-amine
MOLECULAR FORMULA: C11H16N4S+2
MOLECULAR WEIGHT: 236.33654
SMILES: CC1=C(SC=[N+]1CC2=C[NH+]=C(N=C2N)C)C
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Product OPENEYE NAME: methyl 4-(naphthalene-1-carbonylamino)-2,3-dihydrothiophene-5-carboxylate
CAS Name: 4-[[1-naphthalenyl(oxo)methyl]amino]-2,3-dihydrothiophene-5-carboxylic acid methyl ester
IUPAC NAME: methyl 4-(naphthalene-1-carbonylamino)-2,3-dihydrothiophene-5-carboxylate
SYSTEMATIC NAME: methyl 4-(naphthalen-1-ylcarbonylamino)-2,3-dihydrothiophene-5-carboxylate
MOLECULAR FORMULA: C17H15NO3S
MOLECULAR WEIGHT: 313.3709
SMILES: COC(=O)C1=C(CCS1)NC(=O)C2=CC=CC3=CC=CC=C32
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Product OPENEYE NAME: 2-bis[3,5-bis(trifluoromethyl)phenyl]phosphanylethyl-bis[3,5-bis(trifluoromethyl)phenyl]phosphane
CAS Name: 2-bis[3,5-bis(trifluoromethyl)phenyl]phosphinoethyl-bis[3,5-bis(trifluoromethyl)phenyl]phosphine
IUPAC NAME: 2-bis[3,5-bis(trifluoromethyl)phenyl]phosphanylethyl-bis[3,5-bis(trifluoromethyl)phenyl]phosphane
SYSTEMATIC NAME: 2-bis[3,5-bis(trifluoromethyl)phenyl]phosphanylethyl-bis[3,5-bis(trifluoromethyl)phenyl]phosphane
MOLECULAR FORMULA: C34H16F24P2
MOLECULAR WEIGHT: 942.400039
SMILES: C1=C(C=C(C=C1C(F)(F)F)P(CCP(C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F)C(F)(F)F
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Product OPENEYE NAME: 3-bis[3,5-bis(trifluoromethyl)phenyl]phosphanylpropyl-bis[3,5-bis(trifluoromethyl)phenyl]phosphane
CAS Name: 3-bis[3,5-bis(trifluoromethyl)phenyl]phosphinopropyl-bis[3,5-bis(trifluoromethyl)phenyl]phosphine
IUPAC NAME: 3-bis[3,5-bis(trifluoromethyl)phenyl]phosphanylpropyl-bis[3,5-bis(trifluoromethyl)phenyl]phosphane
SYSTEMATIC NAME: 3-bis[3,5-bis(trifluoromethyl)phenyl]phosphanylpropyl-bis[3,5-bis(trifluoromethyl)phenyl]phosphane
MOLECULAR FORMULA: C35H18F24P2
MOLECULAR WEIGHT: 956.426619
SMILES: C1=C(C=C(C=C1C(F)(F)F)P(CCCP(C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F)C(F)(F)F
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Product OPENEYE NAME: [4-(5-benzyl-2,6-dimethyl-pyrimidin-4-yl)piperazin-1-yl]-(4-pentylphenyl)methanone
CAS Name: [4-[2,6-dimethyl-5-(phenylmethyl)-4-pyrimidinyl]-1-piperazinyl]-(4-pentylphenyl)methanone
IUPAC NAME: [4-(5-benzyl-2,6-dimethylpyrimidin-4-yl)piperazin-1-yl]-(4-pentylphenyl)methanone
SYSTEMATIC NAME: [4-[2,6-dimethyl-5-(phenylmethyl)pyrimidin-4-yl]piperazin-1-yl]-(4-pentylphenyl)methanone
MOLECULAR FORMULA: C29H36N4O
MOLECULAR WEIGHT: 456.62234
SMILES: CCCCCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC(=NC(=C3CC4=CC=CC=C4)C)C
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Product OPENEYE NAME: N-[(4-butoxyphenyl)methyleneamino]-2-(4-methoxy-N-methylsulfonyl-anilino)propanamide
CAS Name: N-[(4-butoxyphenyl)methylideneamino]-2-(4-methoxy-N-methylsulfonylanilino)propanamide
IUPAC NAME: N-[(4-butoxyphenyl)methylideneamino]-2-(4-methoxy-N-methylsulfonylanilino)propanamide
SYSTEMATIC NAME: N-[(4-butoxyphenyl)methylideneamino]-2-[(4-methoxyphenyl)-methylsulfonyl-amino]propanamide
MOLECULAR FORMULA: C22H29N3O5S
MOLECULAR WEIGHT: 447.54776
SMILES: CCCCOC1=CC=C(C=C1)C=NNC(=O)C(C)N(C2=CC=C(C=C2)OC)S(=O)(=O)C
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Product OPENEYE NAME: N-[(2,4-dichlorophenyl)methyleneamino]-2,4-dinitro-aniline
CAS Name: N-[(2,4-dichlorophenyl)methylideneamino]-2,4-dinitroaniline
IUPAC NAME: N-[(2,4-dichlorophenyl)methylideneamino]-2,4-dinitroaniline
SYSTEMATIC NAME: N-[(2,4-dichlorophenyl)methylideneamino]-2,4-dinitro-aniline
MOLECULAR FORMULA: C13H8Cl2N4O4
MOLECULAR WEIGHT: 355.13302
SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NN=CC2=C(C=C(C=C2)Cl)Cl
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Product OPENEYE NAME: 2-[N-(benzenesulfonyl)-2-methyl-anilino]-N-[(2-fluorophenyl)methyleneamino]acetamide
CAS Name: 2-[N-(benzenesulfonyl)-2-methylanilino]-N-[(2-fluorophenyl)methylideneamino]acetamide
IUPAC NAME: 2-[N-(benzenesulfonyl)-2-methylanilino]-N-[(2-fluorophenyl)methylideneamino]acetamide
SYSTEMATIC NAME: N-[(2-fluorophenyl)methylideneamino]-2-[(2-methylphenyl)-(phenylsulfonyl)amino]ethanamide
MOLECULAR FORMULA: C22H20FN3O3S
MOLECULAR WEIGHT: 425.475903
SMILES: CC1=CC=CC=C1N(CC(=O)NN=CC2=CC=CC=C2F)S(=O)(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 3-(4-chlorophenyl)-4-imino-2,6-bis(methylsulfanyl)-3H-pyridine-5-carbonitrile
CAS Name: 3-(4-chlorophenyl)-4-imino-2,6-bis(methylthio)-3H-pyridine-5-carbonitrile
IUPAC NAME: 3-(4-chlorophenyl)-4-imino-2,6-bis(methylsulfanyl)-3H-pyridine-5-carbonitrile
SYSTEMATIC NAME: 4-azanylidene-3-(4-chlorophenyl)-2,6-bis(methylsulfanyl)-3H-pyridine-5-carbonitrile
MOLECULAR FORMULA: C14H12ClN3S2
MOLECULAR WEIGHT: 321.84818
SMILES: CSC1=NC(=C(C(=N)C1C2=CC=C(C=C2)Cl)C#N)SC
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