Thursday, November 1, 2012

All Chemical Compounds Information




Product OPENEYE NAME: N-(1,3-benzodioxol-5-ylmethyl)thiophene-3-carboxamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-thiophenecarboxamide
IUPAC NAME: N-(1,3-benzodioxol-5-ylmethyl)thiophene-3-carboxamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)thiophene-3-carboxamide
MOLECULAR FORMULA: C13H11NO3S
MOLECULAR WEIGHT: 261.29634
SMILES: C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CSC=C3
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Product OPENEYE NAME: 4-hydroxy-N-(5-methyl-1H-pyrazol-3-yl)butanamide
CAS Name: 4-hydroxy-N-(5-methyl-1H-pyrazol-3-yl)butanamide
IUPAC NAME: 4-hydroxy-N-(5-methyl-1H-pyrazol-3-yl)butanamide
SYSTEMATIC NAME: N-(5-methyl-1H-pyrazol-3-yl)-4-oxidanyl-butanamide
MOLECULAR FORMULA: C8H13N3O2
MOLECULAR WEIGHT: 183.20772
SMILES: CC1=CC(=NN1)NC(=O)CCCO
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Product OPENEYE NAME: 4-hydroxy-N-[2-(4-methoxyphenoxy)ethyl]butanamide
CAS Name: 4-hydroxy-N-[2-(4-methoxyphenoxy)ethyl]butanamide
IUPAC NAME: 4-hydroxy-N-[2-(4-methoxyphenoxy)ethyl]butanamide
SYSTEMATIC NAME: N-[2-(4-methoxyphenoxy)ethyl]-4-oxidanyl-butanamide
MOLECULAR FORMULA: C13H19NO4
MOLECULAR WEIGHT: 253.29426
SMILES: COC1=CC=C(C=C1)OCCNC(=O)CCCO
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Product OPENEYE NAME: N-(1,3-benzodioxol-5-ylmethyl)-4-propyl-benzamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-propylbenzamide
IUPAC NAME: N-(1,3-benzodioxol-5-ylmethyl)-4-propylbenzamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-4-propyl-benzamide
MOLECULAR FORMULA: C18H19NO3
MOLECULAR WEIGHT: 297.34836
SMILES: CCCC1=CC=C(C=C1)C(=O)NCC2=CC3=C(C=C2)OCO3
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Product OPENEYE NAME: N-(1,3-benzodioxol-5-ylmethyl)-5-tert-butyl-2-methyl-pyrazole-3-carboxamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-tert-butyl-2-methyl-3-pyrazolecarboxamide
IUPAC NAME: N-(1,3-benzodioxol-5-ylmethyl)-5-tert-butyl-2-methylpyrazole-3-carboxamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-5-tert-butyl-2-methyl-pyrazole-3-carboxamide
MOLECULAR FORMULA: C17H21N3O3
MOLECULAR WEIGHT: 315.36694
SMILES: CC(C)(C)C1=NN(C(=C1)C(=O)NCC2=CC3=C(C=C2)OCO3)C
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H15N3OS
MOLECULAR WEIGHT: 297.3748
SMILES: C1CN(CC2=C1SC3=C2C(=O)NC=N3)CC4=CC=CC=C4
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Product OPENEYE NAME: 3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propanoic acid
CAS Name: 3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoic acid
IUPAC NAME: 3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoic acid
SYSTEMATIC NAME: 3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanoic acid
MOLECULAR FORMULA: C9H8N2O3S
MOLECULAR WEIGHT: 224.23642
SMILES: C1=CSC(=C1)C2=NOC(=N2)CCC(=O)O
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Product OPENEYE NAME: N-(1,3-benzodioxol-5-ylmethyl)-1-phenyl-5-propyl-pyrazole-4-carboxamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-phenyl-5-propyl-4-pyrazolecarboxamide
IUPAC NAME: N-(1,3-benzodioxol-5-ylmethyl)-1-phenyl-5-propylpyrazole-4-carboxamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-1-phenyl-5-propyl-pyrazole-4-carboxamide
MOLECULAR FORMULA: C21H21N3O3
MOLECULAR WEIGHT: 363.40974
SMILES: CCCC1=C(C=NN1C2=CC=CC=C2)C(=O)NCC3=CC4=C(C=C3)OCO4
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Product OPENEYE NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-phenoxy-pyridine-3-carboxamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-phenoxy-3-pyridinecarboxamide
IUPAC NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-phenoxypyridine-3-carboxamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-2-phenoxy-pyridine-3-carboxamide
MOLECULAR FORMULA: C20H16N2O4
MOLECULAR WEIGHT: 348.35204
SMILES: C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(N=CC=C3)OC4=CC=CC=C4
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Product OPENEYE NAME: N-(1,3-benzodioxol-5-ylmethyl)-3-bromo-thiophene-2-carboxamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-bromo-2-thiophenecarboxamide
IUPAC NAME: N-(1,3-benzodioxol-5-ylmethyl)-3-bromothiophene-2-carboxamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-3-bromanyl-thiophene-2-carboxamide
MOLECULAR FORMULA: C13H10BrNO3S
MOLECULAR WEIGHT: 340.1924
SMILES: C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(C=CS3)Br
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Product OPENEYE NAME: N-(1,3-benzodioxol-5-ylmethyl)-4-(trifluoromethoxy)benzamide
CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(trifluoromethoxy)benzamide
IUPAC NAME: N-(1,3-benzodioxol-5-ylmethyl)-4-(trifluoromethoxy)benzamide
SYSTEMATIC NAME: N-(1,3-benzodioxol-5-ylmethyl)-4-(trifluoromethyloxy)benzamide
MOLECULAR FORMULA: C16H12F3NO4
MOLECULAR WEIGHT: 339.26599
SMILES: C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=C(C=C3)OC(F)(F)F
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Product OPENEYE NAME: N-[4-bromo-3-(trifluoromethyl)phenyl]-2-(2-naphthyl)acetamide
CAS Name: N-[4-bromo-3-(trifluoromethyl)phenyl]-2-(2-naphthalenyl)acetamide
IUPAC NAME: N-[4-bromo-3-(trifluoromethyl)phenyl]-2-naphthalen-2-ylacetamide
SYSTEMATIC NAME: N-[4-bromanyl-3-(trifluoromethyl)phenyl]-2-naphthalen-2-yl-ethanamide
MOLECULAR FORMULA: C19H13BrF3NO
MOLECULAR WEIGHT: 408.21183
SMILES: C1=CC=C2C=C(C=CC2=C1)CC(=O)NC3=CC(=C(C=C3)Br)C(F)(F)F
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Product OPENEYE NAME: (2-morpholinophenyl) 2-phenoxypyridine-3-carboxylate
CAS Name: 2-phenoxy-3-pyridinecarboxylic acid [2-(4-morpholinyl)phenyl] ester
IUPAC NAME: (2-morpholin-4-ylphenyl) 2-phenoxypyridine-3-carboxylate
SYSTEMATIC NAME: (2-morpholin-4-ylphenyl) 2-phenoxypyridine-3-carboxylate
MOLECULAR FORMULA: C22H20N2O4
MOLECULAR WEIGHT: 376.4052
SMILES: C1COCCN1C2=CC=CC=C2OC(=O)C3=C(N=CC=C3)OC4=CC=CC=C4
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Product OPENEYE NAME: (2-morpholinophenyl) 3-bromothiophene-2-carboxylate
CAS Name: 3-bromo-2-thiophenecarboxylic acid [2-(4-morpholinyl)phenyl] ester
IUPAC NAME: (2-morpholin-4-ylphenyl) 3-bromothiophene-2-carboxylate
SYSTEMATIC NAME: (2-morpholin-4-ylphenyl) 3-bromanylthiophene-2-carboxylate
MOLECULAR FORMULA: C15H14BrNO3S
MOLECULAR WEIGHT: 368.24556
SMILES: C1COCCN1C2=CC=CC=C2OC(=O)C3=C(C=CS3)Br
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Product OPENEYE NAME: methyl 2-[4-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)-1,4-diazepan-1-yl]-4-(trifluoromethyl)pyrimidine-5-carboxylate
CAS Name: 2-[4-[(5-tert-butyl-2-methyl-3-pyrazolyl)-oxomethyl]-1,4-diazepan-1-yl]-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid methyl ester
IUPAC NAME: methyl 2-[4-(5-tert-butyl-2-methylpyrazole-3-carbonyl)-1,4-diazepan-1-yl]-4-(trifluoromethyl)pyrimidine-5-carboxylate
SYSTEMATIC NAME: methyl 2-[4-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonyl-1,4-diazepan-1-yl]-4-(trifluoromethyl)pyrimidine-5-carboxylate
MOLECULAR FORMULA: C21H27F3N6O3
MOLECULAR WEIGHT: 468.47269
SMILES: CC(C)(C)C1=NN(C(=C1)C(=O)N2CCCN(CC2)C3=NC=C(C(=N3)C(F)(F)F)C(=O)OC)C
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Product OPENEYE NAME: methyl 2-[4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)-1,4-diazepan-1-yl]-4-(trifluoromethyl)pyrimidine-5-carboxylate
CAS Name: 2-[4-[2,3-dihydro-1,4-benzodioxin-3-yl(oxo)methyl]-1,4-diazepan-1-yl]-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid methyl ester
IUPAC NAME: methyl 2-[4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)-1,4-diazepan-1-yl]-4-(trifluoromethyl)pyrimidine-5-carboxylate
SYSTEMATIC NAME: methyl 2-[4-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonyl)-1,4-diazepan-1-yl]-4-(trifluoromethyl)pyrimidine-5-carboxylate
MOLECULAR FORMULA: C21H21F3N4O5
MOLECULAR WEIGHT: 466.41045
SMILES: COC(=O)C1=CN=C(N=C1C(F)(F)F)N2CCCN(CC2)C(=O)C3COC4=CC=CC=C4O3
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Product OPENEYE NAME: methyl 2-[4-(cyclohexylcarbamoyl)-1,4-diazepan-1-yl]-4-(trifluoromethyl)pyrimidine-5-carboxylate
CAS Name: 2-[4-[(cyclohexylamino)-oxomethyl]-1,4-diazepan-1-yl]-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid methyl ester
IUPAC NAME: methyl 2-[4-(cyclohexylcarbamoyl)-1,4-diazepan-1-yl]-4-(trifluoromethyl)pyrimidine-5-carboxylate
SYSTEMATIC NAME: methyl 2-[4-(cyclohexylcarbamoyl)-1,4-diazepan-1-yl]-4-(trifluoromethyl)pyrimidine-5-carboxylate
MOLECULAR FORMULA: C19H26F3N5O3
MOLECULAR WEIGHT: 429.43665
SMILES: COC(=O)C1=CN=C(N=C1C(F)(F)F)N2CCCN(CC2)C(=O)NC3CCCCC3
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Product OPENEYE NAME: methyl 2-[4-[(4-benzyloxyphenyl)carbamoyl]-1,4-diazepan-1-yl]-4-(trifluoromethyl)pyrimidine-5-carboxylate
CAS Name: 2-[4-[oxo-(4-phenylmethoxyanilino)methyl]-1,4-diazepan-1-yl]-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid methyl ester
IUPAC NAME: methyl 2-[4-[(4-phenylmethoxyphenyl)carbamoyl]-1,4-diazepan-1-yl]-4-(trifluoromethyl)pyrimidine-5-carboxylate
SYSTEMATIC NAME: methyl 2-[4-[(4-phenylmethoxyphenyl)carbamoyl]-1,4-diazepan-1-yl]-4-(trifluoromethyl)pyrimidine-5-carboxylate
MOLECULAR FORMULA: C26H26F3N5O4
MOLECULAR WEIGHT: 529.51095
SMILES: COC(=O)C1=CN=C(N=C1C(F)(F)F)N2CCCN(CC2)C(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4
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