Thursday, May 30, 2013

All Chemical Compounds Information




Product OPENEYE NAME: N-(2-chloro-5-methylsulfonyl-phenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-acetamide
CAS Name: N-(2-chloro-5-methylsulfonylphenyl)-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]acetamide
IUPAC NAME: N-(2-chloro-5-methylsulfonylphenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetamide
SYSTEMATIC NAME: N-(2-chloranyl-5-methylsulfonyl-phenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide
MOLECULAR FORMULA: C14H11ClF3N3O3S2
MOLECULAR WEIGHT: 425.83365
SMILES: CS(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=O)CSC2=NC=CC(=N2)C(F)(F)F
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Product OPENEYE NAME: 2-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethylsulfanyl]-4-(trifluoromethyl)pyrimidine
CAS Name: 2-[2-[(2R)-1-methyl-2-piperidin-1-iumyl]ethylthio]-4-(trifluoromethyl)pyrimidine
IUPAC NAME: 2-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethylsulfanyl]-4-(trifluoromethyl)pyrimidine
SYSTEMATIC NAME: 2-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethylsulfanyl]-4-(trifluoromethyl)pyrimidine
MOLECULAR FORMULA: C13H19F3N3S+
MOLECULAR WEIGHT: 306.37027
SMILES: C[NH+]1CCCC[C@@H]1CCSC2=NC=CC(=N2)C(F)(F)F
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Product OPENEYE NAME: 2-[2-[(2R)-1-methyl-2-piperidyl]ethylsulfanyl]-4-(trifluoromethyl)pyrimidine
CAS Name: 2-[2-[(2R)-1-methyl-2-piperidinyl]ethylthio]-4-(trifluoromethyl)pyrimidine
IUPAC NAME: 2-[2-[(2R)-1-methylpiperidin-2-yl]ethylsulfanyl]-4-(trifluoromethyl)pyrimidine
SYSTEMATIC NAME: 2-[2-[(2R)-1-methylpiperidin-2-yl]ethylsulfanyl]-4-(trifluoromethyl)pyrimidine
MOLECULAR FORMULA: C13H18F3N3S
MOLECULAR WEIGHT: 305.36233
SMILES: CN1CCCC[C@@H]1CCSC2=NC=CC(=N2)C(F)(F)F
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Product OPENEYE NAME: 2-[2-[(2S)-1-methylpiperidin-1-ium-2-yl]ethylsulfanyl]-4-(trifluoromethyl)pyrimidine
CAS Name: 2-[2-[(2S)-1-methyl-2-piperidin-1-iumyl]ethylthio]-4-(trifluoromethyl)pyrimidine
IUPAC NAME: 2-[2-[(2S)-1-methylpiperidin-1-ium-2-yl]ethylsulfanyl]-4-(trifluoromethyl)pyrimidine
SYSTEMATIC NAME: 2-[2-[(2S)-1-methylpiperidin-1-ium-2-yl]ethylsulfanyl]-4-(trifluoromethyl)pyrimidine
MOLECULAR FORMULA: C13H19F3N3S+
MOLECULAR WEIGHT: 306.37027
SMILES: C[NH+]1CCCC[C@H]1CCSC2=NC=CC(=N2)C(F)(F)F
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Product OPENEYE NAME: 2-[2-[(2S)-1-methyl-2-piperidyl]ethylsulfanyl]-4-(trifluoromethyl)pyrimidine
CAS Name: 2-[2-[(2S)-1-methyl-2-piperidinyl]ethylthio]-4-(trifluoromethyl)pyrimidine
IUPAC NAME: 2-[2-[(2S)-1-methylpiperidin-2-yl]ethylsulfanyl]-4-(trifluoromethyl)pyrimidine
SYSTEMATIC NAME: 2-[2-[(2S)-1-methylpiperidin-2-yl]ethylsulfanyl]-4-(trifluoromethyl)pyrimidine
MOLECULAR FORMULA: C13H18F3N3S
MOLECULAR WEIGHT: 305.36233
SMILES: CN1CCCC[C@H]1CCSC2=NC=CC(=N2)C(F)(F)F
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Product OPENEYE NAME: N-(4-morpholinophenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide
CAS Name: N-[4-(4-morpholinyl)phenyl]-3-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]propanamide
IUPAC NAME: N-(4-morpholin-4-ylphenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanamide
SYSTEMATIC NAME: N-(4-morpholin-4-ylphenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide
MOLECULAR FORMULA: C18H19F3N4O2S
MOLECULAR WEIGHT: 412.42927
SMILES: C1COCCN1C2=CC=C(C=C2)NC(=O)CCSC3=NC=CC(=N3)C(F)(F)F
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Product OPENEYE NAME: N-(2-methoxyphenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide
CAS Name: N-(2-methoxyphenyl)-3-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]propanamide
IUPAC NAME: N-(2-methoxyphenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanamide
SYSTEMATIC NAME: N-(2-methoxyphenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide
MOLECULAR FORMULA: C15H14F3N3O2S
MOLECULAR WEIGHT: 357.35077
SMILES: COC1=CC=CC=C1NC(=O)CCSC2=NC=CC(=N2)C(F)(F)F
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Product OPENEYE NAME: N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide
CAS Name: N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-3-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]propanamide
IUPAC NAME: N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanamide
SYSTEMATIC NAME: N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide
MOLECULAR FORMULA: C15H12F3N5O2S
MOLECULAR WEIGHT: 383.34829
SMILES: C1=CC2=C(C=C1NC(=O)CCSC3=NC=CC(=N3)C(F)(F)F)NC(=O)N2
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Product OPENEYE NAME: 3-methyl-6-oxo-4-[[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-7H-thieno[2,3-b]pyridine-2-carboxylate
CAS Name: 3-methyl-6-oxo-4-[[[4-(trifluoromethyl)-2-pyrimidinyl]thio]methyl]-7H-thieno[2,3-b]pyridine-2-carboxylate
IUPAC NAME: 3-methyl-6-oxo-4-[[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-7H-thieno[2,3-b]pyridine-2-carboxylate
SYSTEMATIC NAME: 3-methyl-6-oxidanylidene-4-[[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-7H-thieno[2,3-b]pyridine-2-carboxylate
MOLECULAR FORMULA: C15H9F3N3O3S2-
MOLECULAR WEIGHT: 400.37547
SMILES: CC1=C(SC2=C1C(=CC(=O)N2)CSC3=NC=CC(=N3)C(F)(F)F)C(=O)[O-]
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Product OPENEYE NAME: 3-methyl-6-oxo-4-[[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-7H-thieno[2,3-b]pyridine-2-carboxylic acid
CAS Name: 3-methyl-6-oxo-4-[[[4-(trifluoromethyl)-2-pyrimidinyl]thio]methyl]-7H-thieno[2,3-b]pyridine-2-carboxylic acid
IUPAC NAME: 3-methyl-6-oxo-4-[[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-7H-thieno[2,3-b]pyridine-2-carboxylic acid
SYSTEMATIC NAME: 3-methyl-6-oxidanylidene-4-[[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-7H-thieno[2,3-b]pyridine-2-carboxylic acid
MOLECULAR FORMULA: C15H10F3N3O3S2
MOLECULAR WEIGHT: 401.38341
SMILES: CC1=C(SC2=C1C(=CC(=O)N2)CSC3=NC=CC(=N3)C(F)(F)F)C(=O)O
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Product OPENEYE NAME: N-(3-nitrophenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide
CAS Name: N-(3-nitrophenyl)-3-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]propanamide
IUPAC NAME: N-(3-nitrophenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanamide
SYSTEMATIC NAME: N-(3-nitrophenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide
MOLECULAR FORMULA: C14H11F3N4O3S
MOLECULAR WEIGHT: 372.32235
SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CCSC2=NC=CC(=N2)C(F)(F)F
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Product OPENEYE NAME: N-(4-methoxy-2-nitro-phenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide
CAS Name: N-(4-methoxy-2-nitrophenyl)-3-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]propanamide
IUPAC NAME: N-(4-methoxy-2-nitrophenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanamide
SYSTEMATIC NAME: N-(4-methoxy-2-nitro-phenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide
MOLECULAR FORMULA: C15H13F3N4O4S
MOLECULAR WEIGHT: 402.34833
SMILES: COC1=CC(=C(C=C1)NC(=O)CCSC2=NC=CC(=N2)C(F)(F)F)[N+](=O)[O-]
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Product OPENEYE NAME: N-(2-nitrophenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide
CAS Name: N-(2-nitrophenyl)-3-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]propanamide
IUPAC NAME: N-(2-nitrophenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanamide
SYSTEMATIC NAME: N-(2-nitrophenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide
MOLECULAR FORMULA: C14H11F3N4O3S
MOLECULAR WEIGHT: 372.32235
SMILES: C1=CC=C(C(=C1)NC(=O)CCSC2=NC=CC(=N2)C(F)(F)F)[N+](=O)[O-]
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Product OPENEYE NAME: N-(4-nitrophenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide
CAS Name: N-(4-nitrophenyl)-3-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]propanamide
IUPAC NAME: N-(4-nitrophenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanamide
SYSTEMATIC NAME: N-(4-nitrophenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide
MOLECULAR FORMULA: C14H11F3N4O3S
MOLECULAR WEIGHT: 372.32235
SMILES: C1=CC(=CC=C1NC(=O)CCSC2=NC=CC(=N2)C(F)(F)F)[N+](=O)[O-]
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Product OPENEYE NAME: N-(2-methoxy-4-nitro-phenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide
CAS Name: N-(2-methoxy-4-nitrophenyl)-3-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]propanamide
IUPAC NAME: N-(2-methoxy-4-nitrophenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanamide
SYSTEMATIC NAME: N-(2-methoxy-4-nitro-phenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide
MOLECULAR FORMULA: C15H13F3N4O4S
MOLECULAR WEIGHT: 402.34833
SMILES: COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CCSC2=NC=CC(=N2)C(F)(F)F
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Product OPENEYE NAME: N-(3-cyanophenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide
CAS Name: N-(3-cyanophenyl)-3-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]propanamide
IUPAC NAME: N-(3-cyanophenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanamide
SYSTEMATIC NAME: N-(3-cyanophenyl)-3-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide
MOLECULAR FORMULA: C15H11F3N4OS
MOLECULAR WEIGHT: 352.33425
SMILES: C1=CC(=CC(=C1)NC(=O)CCSC2=NC=CC(=N2)C(F)(F)F)C#N
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Product OPENEYE NAME: N-[(3-fluoro-4-methyl-phenyl)methyl]-1,3,5-trimethyl-pyrazole-4-carboxamide
CAS Name: N-[(3-fluoro-4-methylphenyl)methyl]-1,3,5-trimethyl-4-pyrazolecarboxamide
IUPAC NAME: N-[(3-fluoro-4-methylphenyl)methyl]-1,3,5-trimethylpyrazole-4-carboxamide
SYSTEMATIC NAME: N-[(3-fluoranyl-4-methyl-phenyl)methyl]-1,3,5-trimethyl-pyrazole-4-carboxamide
MOLECULAR FORMULA: C15H18FN3O
MOLECULAR WEIGHT: 275.321323
SMILES: CC1=C(C=C(C=C1)CNC(=O)C2=C(N(N=C2C)C)C)F
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Product OPENEYE NAME: N-(6-chloro-1,3-benzodioxol-5-yl)-2-(1,2,4-triazol-1-yl)acetamide
CAS Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-(1,2,4-triazol-1-yl)acetamide
IUPAC NAME: N-(6-chloro-1,3-benzodioxol-5-yl)-2-(1,2,4-triazol-1-yl)acetamide
SYSTEMATIC NAME: N-(6-chloranyl-1,3-benzodioxol-5-yl)-2-(1,2,4-triazol-1-yl)ethanamide
MOLECULAR FORMULA: C11H9ClN4O3
MOLECULAR WEIGHT: 280.66716
SMILES: C1OC2=C(O1)C=C(C(=C2)NC(=O)CN3C=NC=N3)Cl
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Product OPENEYE NAME: N-ethoxy-2-(2-methylphenoxy)acetamide
CAS Name: N-ethoxy-2-(2-methylphenoxy)acetamide
IUPAC NAME: N-ethoxy-2-(2-methylphenoxy)acetamide
SYSTEMATIC NAME: N-ethoxy-2-(2-methylphenoxy)ethanamide
MOLECULAR FORMULA: C11H15NO3
MOLECULAR WEIGHT: 209.2417
SMILES: CCONC(=O)COC1=CC=CC=C1C
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Product OPENEYE NAME: 2-chloro-N-ethoxy-4-fluoro-benzamide
CAS Name: 2-chloro-N-ethoxy-4-fluorobenzamide
IUPAC NAME: 2-chloro-N-ethoxy-4-fluorobenzamide
SYSTEMATIC NAME: 2-chloranyl-N-ethoxy-4-fluoranyl-benzamide
MOLECULAR FORMULA: C9H9ClFNO2
MOLECULAR WEIGHT: 217.624663
SMILES: CCONC(=O)C1=C(C=C(C=C1)F)Cl
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