Thursday, January 26, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 6-[5-(4-methoxyphenyl)-3-pyridyl]-N-(3-methoxypropyl)-2-phenyl-pyrimidin-4-amine
CAS Name: 6-[5-(4-methoxyphenyl)-3-pyridinyl]-N-(3-methoxypropyl)-2-phenyl-4-pyrimidinamine
IUPAC NAME: 6-[5-(4-methoxyphenyl)pyridin-3-yl]-N-(3-methoxypropyl)-2-phenylpyrimidin-4-amine
SYSTEMATIC NAME: 6-[5-(4-methoxyphenyl)pyridin-3-yl]-N-(3-methoxypropyl)-2-phenyl-pyrimidin-4-amine
MOLECULAR FORMULA: C26H26N4O2
MOLECULAR WEIGHT: 426.51024
SMILES: COCCCNC1=NC(=NC(=C1)C2=CN=CC(=C2)C3=CC=C(C=C3)OC)C4=CC=CC=C4
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Product OPENEYE NAME: 2-[4-[2-methyl-6-(2-pyridyl)pyrimidin-4-yl]piperazin-1-yl]ethanol
CAS Name: 2-[4-[2-methyl-6-(2-pyridinyl)-4-pyrimidinyl]-1-piperazinyl]ethanol
IUPAC NAME: 2-[4-(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol
SYSTEMATIC NAME: 2-[4-(2-methyl-6-pyridin-2-yl-pyrimidin-4-yl)piperazin-1-yl]ethanol
MOLECULAR FORMULA: C16H21N5O
MOLECULAR WEIGHT: 299.37084
SMILES: CC1=NC(=CC(=N1)N2CCN(CC2)CCO)C3=CC=CC=N3
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Product OPENEYE NAME: ethyl 4-[6-(4-fluorophenyl)-2-(4-pyridyl)pyrimidin-4-yl]piperazine-1-carboxylate
CAS Name: 4-[6-(4-fluorophenyl)-2-pyridin-4-yl-4-pyrimidinyl]-1-piperazinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 4-[6-(4-fluorophenyl)-2-pyridin-4-ylpyrimidin-4-yl]piperazine-1-carboxylate
SYSTEMATIC NAME: ethyl 4-[6-(4-fluorophenyl)-2-pyridin-4-yl-pyrimidin-4-yl]piperazine-1-carboxylate
MOLECULAR FORMULA: C22H22FN5O2
MOLECULAR WEIGHT: 407.440783
SMILES: CCOC(=O)N1CCN(CC1)C2=NC(=NC(=C2)C3=CC=C(C=C3)F)C4=CC=NC=C4
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Product OPENEYE NAME: [2-[4-(2-fluoro-4-methylsulfonyl-phenyl)-1,4-diazepane-1-carbonyl]phenyl] acetate
CAS Name: acetic acid [2-[[4-(2-fluoro-4-methylsulfonylphenyl)-1,4-diazepan-1-yl]-oxomethyl]phenyl] ester
IUPAC NAME: [2-[4-(2-fluoro-4-methylsulfonylphenyl)-1,4-diazepane-1-carbonyl]phenyl] acetate
SYSTEMATIC NAME: [2-[[4-(2-fluoranyl-4-methylsulfonyl-phenyl)-1,4-diazepan-1-yl]carbonyl]phenyl] ethanoate
MOLECULAR FORMULA: C21H23FN2O5S
MOLECULAR WEIGHT: 434.481123
SMILES: CC(=O)OC1=CC=CC=C1C(=O)N2CCCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)C)F
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Product OPENEYE NAME: N-(4-chloro-3-nitro-phenyl)-2-(4-phenylpiperazin-1-yl)acetamide
CAS Name: N-(4-chloro-3-nitrophenyl)-2-(4-phenyl-1-piperazinyl)acetamide
IUPAC NAME: N-(4-chloro-3-nitrophenyl)-2-(4-phenylpiperazin-1-yl)acetamide
SYSTEMATIC NAME: N-(4-chloranyl-3-nitro-phenyl)-2-(4-phenylpiperazin-1-yl)ethanamide
MOLECULAR FORMULA: C18H19ClN4O3
MOLECULAR WEIGHT: 374.82146
SMILES: C1CN(CCN1CC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C3=CC=CC=C3
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Product OPENEYE NAME: N'-[(4-allyloxy-3-ethoxy-phenyl)methyleneamino]-N-[3-(trifluoromethyl)phenyl]oxamide
CAS Name: N'-[(3-ethoxy-4-prop-2-enoxyphenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]oxamide
IUPAC NAME: N'-[(3-ethoxy-4-prop-2-enoxyphenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]oxamide
SYSTEMATIC NAME: N'-[(3-ethoxy-4-prop-2-enoxy-phenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]ethanediamide
MOLECULAR FORMULA: C21H20F3N3O4
MOLECULAR WEIGHT: 435.39641
SMILES: CCOC1=C(C=CC(=C1)C=NNC(=O)C(=O)NC2=CC=CC(=C2)C(F)(F)F)OCC=C
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Product OPENEYE NAME: 1-(5-butoxy-2-hydroxy-phenyl)pentan-1-one
CAS Name: 1-(5-butoxy-2-hydroxyphenyl)-1-pentanone
IUPAC NAME: 1-(5-butoxy-2-hydroxyphenyl)pentan-1-one
SYSTEMATIC NAME: 1-(5-butoxy-2-oxidanyl-phenyl)pentan-1-one
MOLECULAR FORMULA: C15H22O3
MOLECULAR WEIGHT: 250.33338
SMILES: CCCCC(=O)C1=C(C=CC(=C1)OCCCC)O
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Product OPENEYE NAME: 5-cinnamylidene-3-(4-fluorobenzoyl)-2-thioxo-thiazolidin-4-one
CAS Name: 5-cinnamylidene-3-[(4-fluorophenyl)-oxomethyl]-2-sulfanylidene-4-thiazolidinone
IUPAC NAME: 5-cinnamylidene-3-(4-fluorobenzoyl)-2-sulfanylidene-1,3-thiazolidin-4-one
SYSTEMATIC NAME: 5-cinnamylidene-3-(4-fluorophenyl)carbonyl-2-sulfanylidene-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C19H12FNO2S2
MOLECULAR WEIGHT: 369.432483
SMILES: C1=CC=C(C=C1)C=CC=C2C(=O)N(C(=S)S2)C(=O)C3=CC=C(C=C3)F
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Product OPENEYE NAME: 2-hydroxy-3-methyl-N-[[1-methyl-3-(3-nitroanilino)-3-oxo-propylidene]amino]benzamide
CAS Name: 2-hydroxy-3-methyl-N-[[4-(3-nitroanilino)-4-oxobutan-2-ylidene]amino]benzamide
IUPAC NAME: 2-hydroxy-3-methyl-N-[[4-(3-nitroanilino)-4-oxobutan-2-ylidene]amino]benzamide
SYSTEMATIC NAME: 3-methyl-N-[[4-[(3-nitrophenyl)amino]-4-oxidanylidene-butan-2-ylidene]amino]-2-oxidanyl-benzamide
MOLECULAR FORMULA: C18H18N4O5
MOLECULAR WEIGHT: 370.35932
SMILES: CC1=CC=CC(=C1O)C(=O)NN=C(C)CC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]
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Product OPENEYE NAME: 1-(4-ethoxyphenyl)-2-(3-phenyl-3,5,6,7,8,9-hexahydro-2H-imidazo[1,2-a]azepin-1-ium-1-yl)ethanone
CAS Name: 1-(4-ethoxyphenyl)-2-(3-phenyl-3,5,6,7,8,9-hexahydro-2H-imidazo[1,2-a]azepin-1-ium-1-yl)ethanone
IUPAC NAME: 1-(4-ethoxyphenyl)-2-(3-phenyl-3,5,6,7,8,9-hexahydro-2H-imidazo[1,2-a]azepin-1-ium-1-yl)ethanone
SYSTEMATIC NAME: 1-(4-ethoxyphenyl)-2-(3-phenyl-3,5,6,7,8,9-hexahydro-2H-imidazo[1,2-a]azepin-1-ium-1-yl)ethanone
MOLECULAR FORMULA: C24H29N2O2+
MOLECULAR WEIGHT: 377.49926
SMILES: CCOC1=CC=C(C=C1)C(=O)C[N+]2=C3CCCCCN3C(C2)C4=CC=CC=C4
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Product OPENEYE NAME: 3-amino-N2-[3-(diethylsulfamoyl)phenyl]-5-(2,4-dimethylphenyl)imino-N4-(tetrahydrofuran-2-ylmethyl)-2H-thiophene-2,4-dicarboxamide
CAS Name: 3-amino-N2-[3-(diethylsulfamoyl)phenyl]-5-(2,4-dimethylphenyl)imino-N4-(2-oxolanylmethyl)-2H-thiophene-2,4-dicarboxamide
IUPAC NAME: 3-amino-2-N-[3-(diethylsulfamoyl)phenyl]-5-(2,4-dimethylphenyl)imino-4-N-(oxolan-2-ylmethyl)-2H-thiophene-2,4-dicarboxamide
SYSTEMATIC NAME: 3-azanyl-N2-[3-(diethylsulfamoyl)phenyl]-5-(2,4-dimethylphenyl)imino-N4-(oxolan-2-ylmethyl)-2H-thiophene-2,4-dicarboxamide
MOLECULAR FORMULA: C29H37N5O5S2
MOLECULAR WEIGHT: 599.76458
SMILES: CCN(CC)S(=O)(=O)C1=CC=CC(=C1)NC(=O)C2C(=C(C(=NC3=C(C=C(C=C3)C)C)S2)C(=O)NCC4CCCO4)N
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Product OPENEYE NAME: 1-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-N-(1-piperidyl)methanimine
CAS Name: 1-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-N-(1-piperidinyl)methanimine
IUPAC NAME: 1-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)-N-piperidin-1-ylmethanimine
SYSTEMATIC NAME: 1-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-N-piperidin-1-yl-methanimine
MOLECULAR FORMULA: C16H19ClN4
MOLECULAR WEIGHT: 302.80186
SMILES: CC1=NN(C(=C1C=NN2CCCCC2)Cl)C3=CC=CC=C3
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