Monday, January 28, 2013

All Chemical Compounds Information




Product OPENEYE NAME: cyclopropyl-[4-(3,5-dichlorobenzoyl)piperazin-1-yl]methanone
CAS Name: cyclopropyl-[4-[(3,5-dichlorophenyl)-oxomethyl]-1-piperazinyl]methanone
IUPAC NAME: cyclopropyl-[4-(3,5-dichlorobenzoyl)piperazin-1-yl]methanone
SYSTEMATIC NAME: [4-[3,5-bis(chloranyl)phenyl]carbonylpiperazin-1-yl]-cyclopropyl-methanone
MOLECULAR FORMULA: C15H16Cl2N2O2
MOLECULAR WEIGHT: 327.20574
SMILES: C1CC1C(=O)N2CCN(CC2)C(=O)C3=CC(=CC(=C3)Cl)Cl
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Product OPENEYE NAME: 2-propyl-6-[2-(2-thienyl)pyrrolidine-1-carbonyl]pyridazin-3-one
CAS Name: 6-[oxo-(2-thiophen-2-yl-1-pyrrolidinyl)methyl]-2-propyl-3-pyridazinone
IUPAC NAME: 2-propyl-6-(2-thiophen-2-ylpyrrolidine-1-carbonyl)pyridazin-3-one
SYSTEMATIC NAME: 2-propyl-6-(2-thiophen-2-ylpyrrolidin-1-yl)carbonyl-pyridazin-3-one
MOLECULAR FORMULA: C16H19N3O2S
MOLECULAR WEIGHT: 317.40596
SMILES: CCCN1C(=O)C=CC(=N1)C(=O)N2CCCC2C3=CC=CS3
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Product OPENEYE NAME: 2-(2-nitrophenoxy)-1-[2-(2-thienyl)pyrrolidin-1-yl]ethanone
CAS Name: 2-(2-nitrophenoxy)-1-(2-thiophen-2-yl-1-pyrrolidinyl)ethanone
IUPAC NAME: 2-(2-nitrophenoxy)-1-(2-thiophen-2-ylpyrrolidin-1-yl)ethanone
SYSTEMATIC NAME: 2-(2-nitrophenoxy)-1-(2-thiophen-2-ylpyrrolidin-1-yl)ethanone
MOLECULAR FORMULA: C16H16N2O4S
MOLECULAR WEIGHT: 332.37424
SMILES: C1CC(N(C1)C(=O)COC2=CC=CC=C2[N+](=O)[O-])C3=CC=CS3
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Product OPENEYE NAME: 1-[2-(2-thienyl)pyrrolidin-1-yl]propan-1-one
CAS Name: 1-(2-thiophen-2-yl-1-pyrrolidinyl)-1-propanone
IUPAC NAME: 1-(2-thiophen-2-ylpyrrolidin-1-yl)propan-1-one
SYSTEMATIC NAME: 1-(2-thiophen-2-ylpyrrolidin-1-yl)propan-1-one
MOLECULAR FORMULA: C11H15NOS
MOLECULAR WEIGHT: 209.3079
SMILES: CCC(=O)N1CCCC1C2=CC=CS2
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Product OPENEYE NAME: (5-methyl-2-furyl)-[2-(2-thienyl)pyrrolidin-1-yl]methanone
CAS Name: (5-methyl-2-furanyl)-(2-thiophen-2-yl-1-pyrrolidinyl)methanone
IUPAC NAME: (5-methylfuran-2-yl)-(2-thiophen-2-ylpyrrolidin-1-yl)methanone
SYSTEMATIC NAME: (5-methylfuran-2-yl)-(2-thiophen-2-ylpyrrolidin-1-yl)methanone
MOLECULAR FORMULA: C14H15NO2S
MOLECULAR WEIGHT: 261.3394
SMILES: CC1=CC=C(O1)C(=O)N2CCCC2C3=CC=CS3
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Product OPENEYE NAME: 3-(2,5-dioxoimidazolidin-4-yl)-N-(3-oxo-4H-1,4-benzoxazin-6-yl)propanamide
CAS Name: 3-(2,5-dioxo-4-imidazolidinyl)-N-(3-oxo-4H-1,4-benzoxazin-6-yl)propanamide
IUPAC NAME: 3-(2,5-dioxoimidazolidin-4-yl)-N-(3-oxo-4H-1,4-benzoxazin-6-yl)propanamide
SYSTEMATIC NAME: 3-[2,5-bis(oxidanylidene)imidazolidin-4-yl]-N-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)propanamide
MOLECULAR FORMULA: C14H14N4O5
MOLECULAR WEIGHT: 318.28476
SMILES: C1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)CCC3C(=O)NC(=O)N3
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Product OPENEYE NAME: N-[2-oxo-2-[(3-oxo-4H-1,4-benzoxazin-6-yl)amino]ethyl]cyclohexanecarboxamide
CAS Name: N-[2-oxo-2-[(3-oxo-4H-1,4-benzoxazin-6-yl)amino]ethyl]cyclohexanecarboxamide
IUPAC NAME: N-[2-oxo-2-[(3-oxo-4H-1,4-benzoxazin-6-yl)amino]ethyl]cyclohexanecarboxamide
SYSTEMATIC NAME: N-[2-oxidanylidene-2-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)amino]ethyl]cyclohexanecarboxamide
MOLECULAR FORMULA: C17H21N3O4
MOLECULAR WEIGHT: 331.36634
SMILES: C1CCC(CC1)C(=O)NCC(=O)NC2=CC3=C(C=C2)OCC(=O)N3
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Product OPENEYE NAME: N-[2-(4-fluorophenyl)ethyl]-2-methoxy-acetamide
CAS Name: N-[2-(4-fluorophenyl)ethyl]-2-methoxyacetamide
IUPAC NAME: N-[2-(4-fluorophenyl)ethyl]-2-methoxyacetamide
SYSTEMATIC NAME: N-[2-(4-fluorophenyl)ethyl]-2-methoxy-ethanamide
MOLECULAR FORMULA: C11H14FNO2
MOLECULAR WEIGHT: 211.232763
SMILES: COCC(=O)NCCC1=CC=C(C=C1)F
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Product OPENEYE NAME: N-(2-methoxy-1-methyl-ethyl)-6-oxo-1-propyl-pyridazine-3-carboxamide
CAS Name: N-(1-methoxypropan-2-yl)-6-oxo-1-propyl-3-pyridazinecarboxamide
IUPAC NAME: N-(1-methoxypropan-2-yl)-6-oxo-1-propylpyridazine-3-carboxamide
SYSTEMATIC NAME: N-(1-methoxypropan-2-yl)-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide
MOLECULAR FORMULA: C12H19N3O3
MOLECULAR WEIGHT: 253.29756
SMILES: CCCN1C(=O)C=CC(=N1)C(=O)NC(C)COC
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Product OPENEYE NAME: (E)-N-(2-methoxy-1-methyl-ethyl)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enamide
CAS Name: (E)-N-(1-methoxypropan-2-yl)-3-(1,3,5-trimethyl-4-pyrazolyl)-2-propenamide
IUPAC NAME: (E)-N-(1-methoxypropan-2-yl)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enamide
SYSTEMATIC NAME: (E)-N-(1-methoxypropan-2-yl)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enamide
MOLECULAR FORMULA: C13H21N3O2
MOLECULAR WEIGHT: 251.32474
SMILES: CC1=C(C(=NN1C)C)/C=C/C(=O)NC(C)COC
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Product OPENEYE NAME: 4-ethyl-N-(2-methoxy-1-methyl-ethyl)-5-methyl-thiophene-2-carboxamide
CAS Name: 4-ethyl-N-(1-methoxypropan-2-yl)-5-methyl-2-thiophenecarboxamide
IUPAC NAME: 4-ethyl-N-(1-methoxypropan-2-yl)-5-methylthiophene-2-carboxamide
SYSTEMATIC NAME: 4-ethyl-N-(1-methoxypropan-2-yl)-5-methyl-thiophene-2-carboxamide
MOLECULAR FORMULA: C12H19NO2S
MOLECULAR WEIGHT: 241.34976
SMILES: CCC1=C(SC(=C1)C(=O)NC(C)COC)C
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Product OPENEYE NAME: N-(2-methoxy-1-methyl-ethyl)-5-methyl-thiophene-2-carboxamide
CAS Name: N-(1-methoxypropan-2-yl)-5-methyl-2-thiophenecarboxamide
IUPAC NAME: N-(1-methoxypropan-2-yl)-5-methylthiophene-2-carboxamide
SYSTEMATIC NAME: N-(1-methoxypropan-2-yl)-5-methyl-thiophene-2-carboxamide
MOLECULAR FORMULA: C10H15NO2S
MOLECULAR WEIGHT: 213.2966
SMILES: CC1=CC=C(S1)C(=O)NC(C)COC
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Product OPENEYE NAME: 5-chloro-N-(2-methoxy-1-methyl-ethyl)thiophene-2-carboxamide
CAS Name: 5-chloro-N-(1-methoxypropan-2-yl)-2-thiophenecarboxamide
IUPAC NAME: 5-chloro-N-(1-methoxypropan-2-yl)thiophene-2-carboxamide
SYSTEMATIC NAME: 5-chloranyl-N-(1-methoxypropan-2-yl)thiophene-2-carboxamide
MOLECULAR FORMULA: C9H12ClNO2S
MOLECULAR WEIGHT: 233.71508
SMILES: CC(COC)NC(=O)C1=CC=C(S1)Cl
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Product OPENEYE NAME: N-[2-[(2-methoxy-1-methyl-ethyl)amino]-1-methyl-2-oxo-ethyl]furan-2-carboxamide
CAS Name: N-[1-(1-methoxypropan-2-ylamino)-1-oxopropan-2-yl]-2-furancarboxamide
IUPAC NAME: N-[1-(1-methoxypropan-2-ylamino)-1-oxopropan-2-yl]furan-2-carboxamide
SYSTEMATIC NAME: N-[1-(1-methoxypropan-2-ylamino)-1-oxidanylidene-propan-2-yl]furan-2-carboxamide
MOLECULAR FORMULA: C12H18N2O4
MOLECULAR WEIGHT: 254.28232
SMILES: CC(COC)NC(=O)C(C)NC(=O)C1=CC=CO1
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Product OPENEYE NAME: N-(2-methoxy-1-methyl-ethyl)-2-(o-tolylsulfanyl)acetamide
CAS Name: N-(1-methoxypropan-2-yl)-2-[(2-methylphenyl)thio]acetamide
IUPAC NAME: N-(1-methoxypropan-2-yl)-2-(2-methylphenyl)sulfanylacetamide
SYSTEMATIC NAME: N-(1-methoxypropan-2-yl)-2-(2-methylphenyl)sulfanyl-ethanamide
MOLECULAR FORMULA: C13H19NO2S
MOLECULAR WEIGHT: 253.36046
SMILES: CC1=CC=CC=C1SCC(=O)NC(C)COC
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Product OPENEYE NAME: 2-(2-fluorophenyl)-N-(2-methoxy-1-methyl-ethyl)acetamide
CAS Name: 2-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)acetamide
IUPAC NAME: 2-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)acetamide
SYSTEMATIC NAME: 2-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)ethanamide
MOLECULAR FORMULA: C12H16FNO2
MOLECULAR WEIGHT: 225.259343
SMILES: CC(COC)NC(=O)CC1=CC=CC=C1F
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Product OPENEYE NAME: (E)-N-(2-methoxy-1-methyl-ethyl)-3-(5-methyl-2-furyl)prop-2-enamide
CAS Name: (E)-N-(1-methoxypropan-2-yl)-3-(5-methyl-2-furanyl)-2-propenamide
IUPAC NAME: (E)-N-(1-methoxypropan-2-yl)-3-(5-methylfuran-2-yl)prop-2-enamide
SYSTEMATIC NAME: (E)-N-(1-methoxypropan-2-yl)-3-(5-methylfuran-2-yl)prop-2-enamide
MOLECULAR FORMULA: C12H17NO3
MOLECULAR WEIGHT: 223.26828
SMILES: CC1=CC=C(O1)/C=C/C(=O)NC(C)COC
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Product OPENEYE NAME: N'-[4-(hydroxymethyl)benzoyl]-1,3-benzodioxole-5-carbohydrazide
CAS Name: N'-[[4-(hydroxymethyl)phenyl]-oxomethyl]-1,3-benzodioxole-5-carbohydrazide
IUPAC NAME: N'-[4-(hydroxymethyl)benzoyl]-1,3-benzodioxole-5-carbohydrazide
SYSTEMATIC NAME: N'-[4-(hydroxymethyl)phenyl]carbonyl-1,3-benzodioxole-5-carbohydrazide
MOLECULAR FORMULA: C16H14N2O5
MOLECULAR WEIGHT: 314.29276
SMILES: C1OC2=C(O1)C=C(C=C2)C(=O)NNC(=O)C3=CC=C(C=C3)CO
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Product OPENEYE NAME: N'-(cyclopropanecarbonyl)-3-methyl-thiophene-2-carbohydrazide
CAS Name: N'-[cyclopropyl(oxo)methyl]-3-methyl-2-thiophenecarbohydrazide
IUPAC NAME: N'-(cyclopropanecarbonyl)-3-methylthiophene-2-carbohydrazide
SYSTEMATIC NAME: N'-cyclopropylcarbonyl-3-methyl-thiophene-2-carbohydrazide
MOLECULAR FORMULA: C10H12N2O2S
MOLECULAR WEIGHT: 224.27948
SMILES: CC1=C(SC=C1)C(=O)NNC(=O)C2CC2
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Product OPENEYE NAME: N-[2-[2-(cyclopropanecarbonyl)hydrazino]-1-methyl-2-oxo-ethyl]furan-2-carboxamide
CAS Name: N-[1-[[cyclopropyl(oxo)methyl]hydrazo]-1-oxopropan-2-yl]-2-furancarboxamide
IUPAC NAME: N-[1-[2-(cyclopropanecarbonyl)hydrazinyl]-1-oxopropan-2-yl]furan-2-carboxamide
SYSTEMATIC NAME: N-[1-(2-cyclopropylcarbonylhydrazinyl)-1-oxidanylidene-propan-2-yl]furan-2-carboxamide
MOLECULAR FORMULA: C12H15N3O4
MOLECULAR WEIGHT: 265.2652
SMILES: CC(C(=O)NNC(=O)C1CC1)NC(=O)C2=CC=CO2
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Product OPENEYE NAME: 5-bromo-N'-(cyclopropanecarbonyl)furan-2-carbohydrazide
CAS Name: 5-bromo-N'-[cyclopropyl(oxo)methyl]-2-furancarbohydrazide
IUPAC NAME: 5-bromo-N'-(cyclopropanecarbonyl)furan-2-carbohydrazide
SYSTEMATIC NAME: 5-bromanyl-N'-cyclopropylcarbonyl-furan-2-carbohydrazide
MOLECULAR FORMULA: C9H9BrN2O3
MOLECULAR WEIGHT: 273.08336
SMILES: C1CC1C(=O)NNC(=O)C2=CC=C(O2)Br
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Product OPENEYE NAME: N-(5-chloro-2-methyl-phenyl)-2-ureido-acetamide
CAS Name: 2-(carbamoylamino)-N-(5-chloro-2-methylphenyl)acetamide
IUPAC NAME: 2-(carbamoylamino)-N-(5-chloro-2-methylphenyl)acetamide
SYSTEMATIC NAME: 2-(aminocarbonylamino)-N-(5-chloranyl-2-methyl-phenyl)ethanamide
MOLECULAR FORMULA: C10H12ClN3O2
MOLECULAR WEIGHT: 241.67418
SMILES: CC1=C(C=C(C=C1)Cl)NC(=O)CNC(=O)N
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