Friday, November 2, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 1-butyl-3-(5-tert-butyl-2-methyl-pyrazol-3-yl)urea
CAS Name: 1-butyl-3-(5-tert-butyl-2-methyl-3-pyrazolyl)urea
IUPAC NAME: 1-butyl-3-(5-tert-butyl-2-methylpyrazol-3-yl)urea
SYSTEMATIC NAME: 1-butyl-3-(5-tert-butyl-2-methyl-pyrazol-3-yl)urea
MOLECULAR FORMULA: C13H24N4O
MOLECULAR WEIGHT: 252.35586
SMILES: CCCCNC(=O)NC1=CC(=NN1C)C(C)(C)C
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Product OPENEYE NAME: 1-(5-tert-butyl-2-methyl-pyrazol-3-yl)-3-(3-chloro-2-methyl-phenyl)urea
CAS Name: 1-(5-tert-butyl-2-methyl-3-pyrazolyl)-3-(3-chloro-2-methylphenyl)urea
IUPAC NAME: 1-(5-tert-butyl-2-methylpyrazol-3-yl)-3-(3-chloro-2-methylphenyl)urea
SYSTEMATIC NAME: 1-(5-tert-butyl-2-methyl-pyrazol-3-yl)-3-(3-chloranyl-2-methyl-phenyl)urea
MOLECULAR FORMULA: C16H21ClN4O
MOLECULAR WEIGHT: 320.81714
SMILES: CC1=C(C=CC=C1Cl)NC(=O)NC2=CC(=NN2C)C(C)(C)C
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Product OPENEYE NAME: 5-tert-butyl-N-indan-2-yl-2-methyl-furan-3-carboxamide
CAS Name: 5-tert-butyl-N-(2,3-dihydro-1H-inden-2-yl)-2-methyl-3-furancarboxamide
IUPAC NAME: 5-tert-butyl-N-(2,3-dihydro-1H-inden-2-yl)-2-methylfuran-3-carboxamide
SYSTEMATIC NAME: 5-tert-butyl-N-(2,3-dihydro-1H-inden-2-yl)-2-methyl-furan-3-carboxamide
MOLECULAR FORMULA: C19H23NO2
MOLECULAR WEIGHT: 297.39142
SMILES: CC1=C(C=C(O1)C(C)(C)C)C(=O)NC2CC3=CC=CC=C3C2
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Product OPENEYE NAME: 2-methyl-N-(2-phenylphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide
CAS Name: 2-methyl-N-(2-phenylphenyl)-6-(trifluoromethyl)-3-pyridinecarboxamide
IUPAC NAME: 2-methyl-N-(2-phenylphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide
SYSTEMATIC NAME: 2-methyl-N-(2-phenylphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide
MOLECULAR FORMULA: C20H15F3N2O
MOLECULAR WEIGHT: 356.34111
SMILES: CC1=C(C=CC(=N1)C(F)(F)F)C(=O)NC2=CC=CC=C2C3=CC=CC=C3
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Product OPENEYE NAME: 5-tert-butyl-2-methyl-N-(2-phenylphenyl)pyrazole-3-carboxamide
CAS Name: 5-tert-butyl-2-methyl-N-(2-phenylphenyl)-3-pyrazolecarboxamide
IUPAC NAME: 5-tert-butyl-2-methyl-N-(2-phenylphenyl)pyrazole-3-carboxamide
SYSTEMATIC NAME: 5-tert-butyl-2-methyl-N-(2-phenylphenyl)pyrazole-3-carboxamide
MOLECULAR FORMULA: C21H23N3O
MOLECULAR WEIGHT: 333.42682
SMILES: CC(C)(C)C1=NN(C(=C1)C(=O)NC2=CC=CC=C2C3=CC=CC=C3)C
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Product OPENEYE NAME: 3-[(2-phenylphenyl)carbamoyl]pyrazine-2-carboxylic acid
CAS Name: 3-[oxo-(2-phenylanilino)methyl]-2-pyrazinecarboxylic acid
IUPAC NAME: 3-[(2-phenylphenyl)carbamoyl]pyrazine-2-carboxylic acid
SYSTEMATIC NAME: 3-[(2-phenylphenyl)carbamoyl]pyrazine-2-carboxylic acid
MOLECULAR FORMULA: C18H13N3O3
MOLECULAR WEIGHT: 319.31412
SMILES: C1=CC=C(C=C1)C2=CC=CC=C2NC(=O)C3=NC=CN=C3C(=O)O
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Product OPENEYE NAME: 2-[2-oxo-2-(2-phenylanilino)ethyl]sulfanylacetic acid
CAS Name: 2-[[2-oxo-2-(2-phenylanilino)ethyl]thio]acetic acid
IUPAC NAME: 2-[2-oxo-2-(2-phenylanilino)ethyl]sulfanylacetic acid
SYSTEMATIC NAME: 2-[2-oxidanylidene-2-[(2-phenylphenyl)amino]ethyl]sulfanylethanoic acid
MOLECULAR FORMULA: C16H15NO3S
MOLECULAR WEIGHT: 301.3602
SMILES: C1=CC=C(C=C1)C2=CC=CC=C2NC(=O)CSCC(=O)O
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Product OPENEYE NAME: N-[4-chloro-2-(2-chlorobenzoyl)phenyl]-2-(indan-2-ylamino)acetamide
CAS Name: N-[4-chloro-2-[(2-chlorophenyl)-oxomethyl]phenyl]-2-(2,3-dihydro-1H-inden-2-ylamino)acetamide
IUPAC NAME: N-[4-chloro-2-(2-chlorobenzoyl)phenyl]-2-(2,3-dihydro-1H-inden-2-ylamino)acetamide
SYSTEMATIC NAME: N-[4-chloranyl-2-(2-chlorophenyl)carbonyl-phenyl]-2-(2,3-dihydro-1H-inden-2-ylamino)ethanamide
MOLECULAR FORMULA: C24H20Cl2N2O2
MOLECULAR WEIGHT: 439.3338
SMILES: C1C(CC2=CC=CC=C21)NCC(=O)NC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4Cl
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Product OPENEYE NAME: 1-[2-[4-chloro-2-(2-chlorobenzoyl)anilino]-2-oxo-ethyl]piperidine-4-carboxamide
CAS Name: 1-[2-[4-chloro-2-[(2-chlorophenyl)-oxomethyl]anilino]-2-oxoethyl]-4-piperidinecarboxamide
IUPAC NAME: 1-[2-[4-chloro-2-(2-chlorobenzoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide
SYSTEMATIC NAME: 1-[2-[[4-chloranyl-2-(2-chlorophenyl)carbonyl-phenyl]amino]-2-oxidanylidene-ethyl]piperidine-4-carboxamide
MOLECULAR FORMULA: C21H21Cl2N3O3
MOLECULAR WEIGHT: 434.31574
SMILES: C1CN(CCC1C(=O)N)CC(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3Cl
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Product OPENEYE NAME: 2-(4-benzhydrylpiperazin-1-yl)-N-[4-chloro-2-(2-chlorobenzoyl)phenyl]acetamide
CAS Name: N-[4-chloro-2-[(2-chlorophenyl)-oxomethyl]phenyl]-2-[4-(diphenylmethyl)-1-piperazinyl]acetamide
IUPAC NAME: 2-(4-benzhydrylpiperazin-1-yl)-N-[4-chloro-2-(2-chlorobenzoyl)phenyl]acetamide
SYSTEMATIC NAME: N-[4-chloranyl-2-(2-chlorophenyl)carbonyl-phenyl]-2-[4-(diphenylmethyl)piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C32H29Cl2N3O2
MOLECULAR WEIGHT: 558.49756
SMILES: C1CN(CCN1CC(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3Cl)C(C4=CC=CC=C4)C5=CC=CC=C5
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Product OPENEYE NAME: 1-phenyl-2-[4-(2-thienyl)pyrimidin-2-yl]sulfanyl-ethanone
CAS Name: 1-phenyl-2-[(4-thiophen-2-yl-2-pyrimidinyl)thio]ethanone
IUPAC NAME: 1-phenyl-2-(4-thiophen-2-ylpyrimidin-2-yl)sulfanylethanone
SYSTEMATIC NAME: 1-phenyl-2-(4-thiophen-2-ylpyrimidin-2-yl)sulfanyl-ethanone
MOLECULAR FORMULA: C16H12N2OS2
MOLECULAR WEIGHT: 312.40928
SMILES: C1=CC=C(C=C1)C(=O)CSC2=NC=CC(=N2)C3=CC=CS3
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Product OPENEYE NAME: 1-(4-fluorophenyl)-2-[4-(2-thienyl)pyrimidin-2-yl]sulfanyl-ethanone
CAS Name: 1-(4-fluorophenyl)-2-[(4-thiophen-2-yl-2-pyrimidinyl)thio]ethanone
IUPAC NAME: 1-(4-fluorophenyl)-2-(4-thiophen-2-ylpyrimidin-2-yl)sulfanylethanone
SYSTEMATIC NAME: 1-(4-fluorophenyl)-2-(4-thiophen-2-ylpyrimidin-2-yl)sulfanyl-ethanone
MOLECULAR FORMULA: C16H11FN2OS2
MOLECULAR WEIGHT: 330.399743
SMILES: C1=CSC(=C1)C2=NC(=NC=C2)SCC(=O)C3=CC=C(C=C3)F
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Product OPENEYE NAME: N-phenyl-2-[4-(2-thienyl)pyrimidin-2-yl]sulfanyl-acetamide
CAS Name: N-phenyl-2-[(4-thiophen-2-yl-2-pyrimidinyl)thio]acetamide
IUPAC NAME: N-phenyl-2-(4-thiophen-2-ylpyrimidin-2-yl)sulfanylacetamide
SYSTEMATIC NAME: N-phenyl-2-(4-thiophen-2-ylpyrimidin-2-yl)sulfanyl-ethanamide
MOLECULAR FORMULA: C16H13N3OS2
MOLECULAR WEIGHT: 327.42392
SMILES: C1=CC=C(C=C1)NC(=O)CSC2=NC=CC(=N2)C3=CC=CS3
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Product OPENEYE NAME: 1-morpholino-2-[4-(2-thienyl)pyrimidin-2-yl]sulfanyl-ethanone
CAS Name: 1-(4-morpholinyl)-2-[(4-thiophen-2-yl-2-pyrimidinyl)thio]ethanone
IUPAC NAME: 1-morpholin-4-yl-2-(4-thiophen-2-ylpyrimidin-2-yl)sulfanylethanone
SYSTEMATIC NAME: 1-morpholin-4-yl-2-(4-thiophen-2-ylpyrimidin-2-yl)sulfanyl-ethanone
MOLECULAR FORMULA: C14H15N3O2S2
MOLECULAR WEIGHT: 321.4178
SMILES: C1COCCN1C(=O)CSC2=NC=CC(=N2)C3=CC=CS3
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Product OPENEYE NAME: 2-[4-(2-thienyl)pyrimidin-2-yl]sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide
CAS Name: 2-[(4-thiophen-2-yl-2-pyrimidinyl)thio]-N-[3-(trifluoromethyl)phenyl]acetamide
IUPAC NAME: 2-(4-thiophen-2-ylpyrimidin-2-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide
SYSTEMATIC NAME: 2-(4-thiophen-2-ylpyrimidin-2-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]ethanamide
MOLECULAR FORMULA: C17H12F3N3OS2
MOLECULAR WEIGHT: 395.42189
SMILES: C1=CC(=CC(=C1)NC(=O)CSC2=NC=CC(=N2)C3=CC=CS3)C(F)(F)F
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