Thursday, November 29, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 1-[2-(4-chlorophenyl)sulfanylethylsulfonyl]-4-fluoro-benzene
CAS Name: 1-[2-[(4-chlorophenyl)thio]ethylsulfonyl]-4-fluorobenzene
IUPAC NAME: 1-[2-(4-chlorophenyl)sulfanylethylsulfonyl]-4-fluorobenzene
SYSTEMATIC NAME: 1-[2-(4-chlorophenyl)sulfanylethylsulfonyl]-4-fluoranyl-benzene
MOLECULAR FORMULA: C14H12ClFO2S2
MOLECULAR WEIGHT: 330.825283
SMILES: C1=CC(=CC=C1F)S(=O)(=O)CCSC2=CC=C(C=C2)Cl
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Product OPENEYE NAME: 2-[2-(4-fluorophenyl)sulfonylethylsulfanyl]thiophene
CAS Name: 2-[2-(4-fluorophenyl)sulfonylethylthio]thiophene
IUPAC NAME: 2-[2-(4-fluorophenyl)sulfonylethylsulfanyl]thiophene
SYSTEMATIC NAME: 2-[2-(4-fluorophenyl)sulfonylethylsulfanyl]thiophene
MOLECULAR FORMULA: C12H11FO2S3
MOLECULAR WEIGHT: 302.407943
SMILES: C1=CSC(=C1)SCCS(=O)(=O)C2=CC=C(C=C2)F
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Product OPENEYE NAME: 1-(2-chlorophenyl)-3-[5-(2-phenylethynyl)-3-pyridyl]urea
CAS Name: 1-(2-chlorophenyl)-3-[5-(2-phenylethynyl)-3-pyridinyl]urea
IUPAC NAME: 1-(2-chlorophenyl)-3-[5-(2-phenylethynyl)pyridin-3-yl]urea
SYSTEMATIC NAME: 1-(2-chlorophenyl)-3-[5-(2-phenylethynyl)pyridin-3-yl]urea
MOLECULAR FORMULA: C20H14ClN3O
MOLECULAR WEIGHT: 347.79766
SMILES: C1=CC=C(C=C1)C#CC2=CC(=CN=C2)NC(=O)NC3=CC=CC=C3Cl
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Product OPENEYE NAME: 1-(4-methoxyphenyl)-3-[5-(2-phenylethynyl)-3-pyridyl]urea
CAS Name: 1-(4-methoxyphenyl)-3-[5-(2-phenylethynyl)-3-pyridinyl]urea
IUPAC NAME: 1-(4-methoxyphenyl)-3-[5-(2-phenylethynyl)pyridin-3-yl]urea
SYSTEMATIC NAME: 1-(4-methoxyphenyl)-3-[5-(2-phenylethynyl)pyridin-3-yl]urea
MOLECULAR FORMULA: C21H17N3O2
MOLECULAR WEIGHT: 343.37858
SMILES: COC1=CC=C(C=C1)NC(=O)NC2=CN=CC(=C2)C#CC3=CC=CC=C3
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Product OPENEYE NAME: 1-[5-(2-phenylethynyl)-3-pyridyl]-3-[3-(trifluoromethyl)phenyl]urea
CAS Name: 1-[5-(2-phenylethynyl)-3-pyridinyl]-3-[3-(trifluoromethyl)phenyl]urea
IUPAC NAME: 1-[5-(2-phenylethynyl)pyridin-3-yl]-3-[3-(trifluoromethyl)phenyl]urea
SYSTEMATIC NAME: 1-[5-(2-phenylethynyl)pyridin-3-yl]-3-[3-(trifluoromethyl)phenyl]urea
MOLECULAR FORMULA: C21H14F3N3O
MOLECULAR WEIGHT: 381.35057
SMILES: C1=CC=C(C=C1)C#CC2=CC(=CN=C2)NC(=O)NC3=CC=CC(=C3)C(F)(F)F
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Product OPENEYE NAME: 1-(2-hydroxyethyl)piperidine-4-carboxamide
CAS Name: 1-(2-hydroxyethyl)-4-piperidinecarboxamide
IUPAC NAME: 1-(2-hydroxyethyl)piperidine-4-carboxamide
SYSTEMATIC NAME: 1-(2-hydroxyethyl)piperidine-4-carboxamide
MOLECULAR FORMULA: C8H16N2O2
MOLECULAR WEIGHT: 172.22484
SMILES: C1CN(CCC1C(=O)N)CCO
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Product OPENEYE NAME: 2-(4-carbamoyl-1-piperidyl)ethyl N-(3,5-dichlorophenyl)carbamate
CAS Name: N-(3,5-dichlorophenyl)carbamic acid 2-(4-carbamoyl-1-piperidinyl)ethyl ester
IUPAC NAME: 2-(4-carbamoylpiperidin-1-yl)ethyl N-(3,5-dichlorophenyl)carbamate
SYSTEMATIC NAME: 2-(4-aminocarbonylpiperidin-1-yl)ethyl N-[3,5-bis(chloranyl)phenyl]carbamate
MOLECULAR FORMULA: C15H19Cl2N3O3
MOLECULAR WEIGHT: 360.23566
SMILES: C1CN(CCC1C(=O)N)CCOC(=O)NC2=CC(=CC(=C2)Cl)Cl
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Product OPENEYE NAME: N-[5-(2-phenylethynyl)-3-pyridyl]morpholine-4-carboxamide
CAS Name: N-[5-(2-phenylethynyl)-3-pyridinyl]-4-morpholinecarboxamide
IUPAC NAME: N-[5-(2-phenylethynyl)pyridin-3-yl]morpholine-4-carboxamide
SYSTEMATIC NAME: N-[5-(2-phenylethynyl)pyridin-3-yl]morpholine-4-carboxamide
MOLECULAR FORMULA: C18H17N3O2
MOLECULAR WEIGHT: 307.34648
SMILES: C1COCCN1C(=O)NC2=CN=CC(=C2)C#CC3=CC=CC=C3
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Product OPENEYE NAME: N-[5-(2-phenylethynyl)-3-pyridyl]piperidine-1-carboxamide
CAS Name: N-[5-(2-phenylethynyl)-3-pyridinyl]-1-piperidinecarboxamide
IUPAC NAME: N-[5-(2-phenylethynyl)pyridin-3-yl]piperidine-1-carboxamide
SYSTEMATIC NAME: N-[5-(2-phenylethynyl)pyridin-3-yl]piperidine-1-carboxamide
MOLECULAR FORMULA: C19H19N3O
MOLECULAR WEIGHT: 305.37366
SMILES: C1CCN(CC1)C(=O)NC2=CN=CC(=C2)C#CC3=CC=CC=C3
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Product OPENEYE NAME: N-[5-(2-phenylethynyl)-3-pyridyl]pyrrolidine-1-carboxamide
CAS Name: N-[5-(2-phenylethynyl)-3-pyridinyl]-1-pyrrolidinecarboxamide
IUPAC NAME: N-[5-(2-phenylethynyl)pyridin-3-yl]pyrrolidine-1-carboxamide
SYSTEMATIC NAME: N-[5-(2-phenylethynyl)pyridin-3-yl]pyrrolidine-1-carboxamide
MOLECULAR FORMULA: C18H17N3O
MOLECULAR WEIGHT: 291.34708
SMILES: C1CCN(C1)C(=O)NC2=CN=CC(=C2)C#CC3=CC=CC=C3
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Product OPENEYE NAME: N-(4-chlorophenyl)-5-(2-phenylethynyl)furan-2-carboxamide
CAS Name: N-(4-chlorophenyl)-5-(2-phenylethynyl)-2-furancarboxamide
IUPAC NAME: N-(4-chlorophenyl)-5-(2-phenylethynyl)furan-2-carboxamide
SYSTEMATIC NAME: N-(4-chlorophenyl)-5-(2-phenylethynyl)furan-2-carboxamide
MOLECULAR FORMULA: C19H12ClNO2
MOLECULAR WEIGHT: 321.75708
SMILES: C1=CC=C(C=C1)C#CC2=CC=C(O2)C(=O)NC3=CC=C(C=C3)Cl
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Product OPENEYE NAME: (E)-3-(4-chlorophenyl)sulfonyl-4-(4-pyrrol-1-yl-1-piperidyl)but-3-en-2-one
CAS Name: (E)-3-(4-chlorophenyl)sulfonyl-4-[4-(1-pyrrolyl)-1-piperidinyl]-3-buten-2-one
IUPAC NAME: (E)-3-(4-chlorophenyl)sulfonyl-4-(4-pyrrol-1-ylpiperidin-1-yl)but-3-en-2-one
SYSTEMATIC NAME: (E)-3-(4-chlorophenyl)sulfonyl-4-(4-pyrrol-1-ylpiperidin-1-yl)but-3-en-2-one
MOLECULAR FORMULA: C19H21ClN2O3S
MOLECULAR WEIGHT: 392.89964
SMILES: CC(=O)/C(=C\N1CCC(CC1)N2C=CC=C2)/S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: (E)-2-(2-pyridylsulfonyl)-3-(4-pyrrol-1-yl-1-piperidyl)prop-2-enenitrile
CAS Name: (E)-2-(2-pyridinylsulfonyl)-3-[4-(1-pyrrolyl)-1-piperidinyl]-2-propenenitrile
IUPAC NAME: (E)-2-pyridin-2-ylsulfonyl-3-(4-pyrrol-1-ylpiperidin-1-yl)prop-2-enenitrile
SYSTEMATIC NAME: (E)-2-pyridin-2-ylsulfonyl-3-(4-pyrrol-1-ylpiperidin-1-yl)prop-2-enenitrile
MOLECULAR FORMULA: C17H18N4O2S
MOLECULAR WEIGHT: 342.41542
SMILES: C1CN(CCC1N2C=CC=C2)/C=C(\C#N)/S(=O)(=O)C3=CC=CC=N3
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