Friday, November 30, 2012

All Chemical Compounds Information




Product OPENEYE NAME: N-(3-chloro-2-isopropylsulfanyl-phenyl)acetamide
CAS Name: N-[3-chloro-2-(propan-2-ylthio)phenyl]acetamide
IUPAC NAME: N-(3-chloro-2-propan-2-ylsulfanylphenyl)acetamide
SYSTEMATIC NAME: N-(3-chloranyl-2-propan-2-ylsulfanyl-phenyl)ethanamide
MOLECULAR FORMULA: C11H14ClNOS
MOLECULAR WEIGHT: 243.75296
SMILES: CC(C)SC1=C(C=CC=C1Cl)NC(=O)C
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Product OPENEYE NAME: 4-chloro-N-(3-chloro-2-isopropylsulfanyl-phenyl)benzamide
CAS Name: 4-chloro-N-[3-chloro-2-(propan-2-ylthio)phenyl]benzamide
IUPAC NAME: 4-chloro-N-(3-chloro-2-propan-2-ylsulfanylphenyl)benzamide
SYSTEMATIC NAME: 4-chloranyl-N-(3-chloranyl-2-propan-2-ylsulfanyl-phenyl)benzamide
MOLECULAR FORMULA: C16H15Cl2NOS
MOLECULAR WEIGHT: 340.2674
SMILES: CC(C)SC1=C(C=CC=C1Cl)NC(=O)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: N-(4-methoxyphenyl)quinoline-6-carboxamide
CAS Name: N-(4-methoxyphenyl)-6-quinolinecarboxamide
IUPAC NAME: N-(4-methoxyphenyl)quinoline-6-carboxamide
SYSTEMATIC NAME: N-(4-methoxyphenyl)quinoline-6-carboxamide
MOLECULAR FORMULA: C17H14N2O2
MOLECULAR WEIGHT: 278.30526
SMILES: COC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)N=CC=C3
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Product OPENEYE NAME: N-[3-(trifluoromethyl)phenyl]quinoline-6-carboxamide
CAS Name: N-[3-(trifluoromethyl)phenyl]-6-quinolinecarboxamide
IUPAC NAME: N-[3-(trifluoromethyl)phenyl]quinoline-6-carboxamide
SYSTEMATIC NAME: N-[3-(trifluoromethyl)phenyl]quinoline-6-carboxamide
MOLECULAR FORMULA: C17H11F3N2O
MOLECULAR WEIGHT: 316.27725
SMILES: C1=CC(=CC(=C1)NC(=O)C2=CC3=C(C=C2)N=CC=C3)C(F)(F)F
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Product OPENEYE NAME: 1-(3-chloro-2-isopropylsulfanyl-phenyl)-3-phenyl-urea
CAS Name: 1-[3-chloro-2-(propan-2-ylthio)phenyl]-3-phenylurea
IUPAC NAME: 1-(3-chloro-2-propan-2-ylsulfanylphenyl)-3-phenylurea
SYSTEMATIC NAME: 1-(3-chloranyl-2-propan-2-ylsulfanyl-phenyl)-3-phenyl-urea
MOLECULAR FORMULA: C16H17ClN2OS
MOLECULAR WEIGHT: 320.83698
SMILES: CC(C)SC1=C(C=CC=C1Cl)NC(=O)NC2=CC=CC=C2
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Product OPENEYE NAME: N-(4-chlorophenyl)quinoline-6-carboxamide
CAS Name: N-(4-chlorophenyl)-6-quinolinecarboxamide
IUPAC NAME: N-(4-chlorophenyl)quinoline-6-carboxamide
SYSTEMATIC NAME: N-(4-chlorophenyl)quinoline-6-carboxamide
MOLECULAR FORMULA: C16H11ClN2O
MOLECULAR WEIGHT: 282.72434
SMILES: C1=CC2=C(C=CC(=C2)C(=O)NC3=CC=C(C=C3)Cl)N=C1
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Product OPENEYE NAME: N-benzylquinoline-6-carboxamide
CAS Name: N-(phenylmethyl)-6-quinolinecarboxamide
IUPAC NAME: N-benzylquinoline-6-carboxamide
SYSTEMATIC NAME: N-(phenylmethyl)quinoline-6-carboxamide
MOLECULAR FORMULA: C17H14N2O
MOLECULAR WEIGHT: 262.30586
SMILES: C1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)N=CC=C3
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Product OPENEYE NAME: N-(2-phenylethyl)quinoline-6-carboxamide
CAS Name: N-(2-phenylethyl)-6-quinolinecarboxamide
IUPAC NAME: N-(2-phenylethyl)quinoline-6-carboxamide
SYSTEMATIC NAME: N-(2-phenylethyl)quinoline-6-carboxamide
MOLECULAR FORMULA: C18H16N2O
MOLECULAR WEIGHT: 276.33244
SMILES: C1=CC=C(C=C1)CCNC(=O)C2=CC3=C(C=C2)N=CC=C3
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Product OPENEYE NAME: (4-methoxyphenyl) quinoline-6-carboxylate
CAS Name: 6-quinolinecarboxylic acid (4-methoxyphenyl) ester
IUPAC NAME: (4-methoxyphenyl) quinoline-6-carboxylate
SYSTEMATIC NAME: (4-methoxyphenyl) quinoline-6-carboxylate
MOLECULAR FORMULA: C17H13NO3
MOLECULAR WEIGHT: 279.29002
SMILES: COC1=CC=C(C=C1)OC(=O)C2=CC3=C(C=C2)N=CC=C3
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Product OPENEYE NAME: (4-phenylpiperazin-1-yl)-(6-quinolyl)methanone
CAS Name: (4-phenyl-1-piperazinyl)-(6-quinolinyl)methanone
IUPAC NAME: (4-phenylpiperazin-1-yl)-quinolin-6-ylmethanone
SYSTEMATIC NAME: (4-phenylpiperazin-1-yl)-quinolin-6-yl-methanone
MOLECULAR FORMULA: C20H19N3O
MOLECULAR WEIGHT: 317.38436
SMILES: C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)N=CC=C4
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Product OPENEYE NAME: N-[4-bromo-5-methyl-2-(p-tolylsulfonylamino)phenyl]-4-methyl-benzenesulfonamide
CAS Name: N-[4-bromo-5-methyl-2-[(4-methylphenyl)sulfonylamino]phenyl]-4-methylbenzenesulfonamide
IUPAC NAME: N-[4-bromo-5-methyl-2-[(4-methylphenyl)sulfonylamino]phenyl]-4-methylbenzenesulfonamide
SYSTEMATIC NAME: N-[4-bromanyl-5-methyl-2-[(4-methylphenyl)sulfonylamino]phenyl]-4-methyl-benzenesulfonamide
MOLECULAR FORMULA: C21H21BrN2O4S2
MOLECULAR WEIGHT: 509.43644
SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C(=C2)C)Br)NS(=O)(=O)C3=CC=C(C=C3)C
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Product OPENEYE NAME: 1-(3-chloro-2-isopropylsulfanyl-phenyl)-3-[3-(trifluoromethyl)phenyl]urea
CAS Name: 1-[3-chloro-2-(propan-2-ylthio)phenyl]-3-[3-(trifluoromethyl)phenyl]urea
IUPAC NAME: 1-(3-chloro-2-propan-2-ylsulfanylphenyl)-3-[3-(trifluoromethyl)phenyl]urea
SYSTEMATIC NAME: 1-(3-chloranyl-2-propan-2-ylsulfanyl-phenyl)-3-[3-(trifluoromethyl)phenyl]urea
MOLECULAR FORMULA: C17H16ClF3N2OS
MOLECULAR WEIGHT: 388.83495
SMILES: CC(C)SC1=C(C=CC=C1Cl)NC(=O)NC2=CC=CC(=C2)C(F)(F)F
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Product OPENEYE NAME: 1-(3-chloro-2-isopropylsulfanyl-phenyl)-3-(3,5-dimethylphenyl)urea
CAS Name: 1-[3-chloro-2-(propan-2-ylthio)phenyl]-3-(3,5-dimethylphenyl)urea
IUPAC NAME: 1-(3-chloro-2-propan-2-ylsulfanylphenyl)-3-(3,5-dimethylphenyl)urea
SYSTEMATIC NAME: 1-(3-chloranyl-2-propan-2-ylsulfanyl-phenyl)-3-(3,5-dimethylphenyl)urea
MOLECULAR FORMULA: C18H21ClN2OS
MOLECULAR WEIGHT: 348.89014
SMILES: CC1=CC(=CC(=C1)NC(=O)NC2=C(C(=CC=C2)Cl)SC(C)C)C
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Product OPENEYE NAME: 3-(1-benzyl-4-piperidyl)triazolo[4,5-b]pyridine
CAS Name: 3-[1-(phenylmethyl)-4-piperidinyl]triazolo[4,5-b]pyridine
IUPAC NAME: 3-(1-benzylpiperidin-4-yl)triazolo[4,5-b]pyridine
SYSTEMATIC NAME: 3-[1-(phenylmethyl)piperidin-4-yl]-[1,2,3]triazolo[4,5-b]pyridine
MOLECULAR FORMULA: C17H19N5
MOLECULAR WEIGHT: 293.36626
SMILES: C1CN(CCC1N2C3=C(C=CC=N3)N=N2)CC4=CC=CC=C4
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Product OPENEYE NAME: 1-(3-chloro-2-isopropylsulfanyl-phenyl)-3-(4-chlorophenyl)urea
CAS Name: 1-(4-chlorophenyl)-3-[3-chloro-2-(propan-2-ylthio)phenyl]urea
IUPAC NAME: 1-(4-chlorophenyl)-3-(3-chloro-2-propan-2-ylsulfanylphenyl)urea
SYSTEMATIC NAME: 1-(3-chloranyl-2-propan-2-ylsulfanyl-phenyl)-3-(4-chlorophenyl)urea
MOLECULAR FORMULA: C16H16Cl2N2OS
MOLECULAR WEIGHT: 355.28204
SMILES: CC(C)SC1=C(C=CC=C1Cl)NC(=O)NC2=CC=C(C=C2)Cl
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Product OPENEYE NAME: 2-isopropylsulfanyl-3,5-dinitro-benzoic acid
CAS Name: 3,5-dinitro-2-(propan-2-ylthio)benzoic acid
IUPAC NAME: 3,5-dinitro-2-propan-2-ylsulfanylbenzoic acid
SYSTEMATIC NAME: 3,5-dinitro-2-propan-2-ylsulfanyl-benzoic acid
MOLECULAR FORMULA: C10H10N2O6S
MOLECULAR WEIGHT: 286.2612
SMILES: CC(C)SC1=C(C=C(C=C1C(=O)O)[N+](=O)[O-])[N+](=O)[O-]
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