Monday, January 28, 2013

All Chemical Compounds Information




Product OPENEYE NAME: N,N-dimethyl-3-[[1-(2-thienyl)ethylamino]methyl]benzenesulfonamide
CAS Name: N,N-dimethyl-3-[(1-thiophen-2-ylethylamino)methyl]benzenesulfonamide
IUPAC NAME: N,N-dimethyl-3-[(1-thiophen-2-ylethylamino)methyl]benzenesulfonamide
SYSTEMATIC NAME: N,N-dimethyl-3-[(1-thiophen-2-ylethylamino)methyl]benzenesulfonamide
MOLECULAR FORMULA: C15H20N2O2S2
MOLECULAR WEIGHT: 324.4615
SMILES: CC(C1=CC=CS1)NCC2=CC(=CC=C2)S(=O)(=O)N(C)C
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Product OPENEYE NAME: 4-[[4-(2-methylsulfonylethyl)piperazin-1-yl]methyl]benzonitrile
CAS Name: 4-[[4-(2-methylsulfonylethyl)-1-piperazinyl]methyl]benzonitrile
IUPAC NAME: 4-[[4-(2-methylsulfonylethyl)piperazin-1-yl]methyl]benzonitrile
SYSTEMATIC NAME: 4-[[4-(2-methylsulfonylethyl)piperazin-1-yl]methyl]benzenecarbonitrile
MOLECULAR FORMULA: C15H21N3O2S
MOLECULAR WEIGHT: 307.41114
SMILES: CS(=O)(=O)CCN1CCN(CC1)CC2=CC=C(C=C2)C#N
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Product OPENEYE NAME: N-(1-cyanocyclopentyl)-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]acetamide
CAS Name: N-(1-cyanocyclopentyl)-2-[4-[(2-fluorophenyl)methyl]-1-piperazinyl]acetamide
IUPAC NAME: N-(1-cyanocyclopentyl)-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]acetamide
SYSTEMATIC NAME: N-(1-cyanocyclopentyl)-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C19H25FN4O
MOLECULAR WEIGHT: 344.426403
SMILES: C1CCC(C1)(C#N)NC(=O)CN2CCN(CC2)CC3=CC=CC=C3F
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Product OPENEYE NAME: 2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-N-(3-methoxypropyl)acetamide
CAS Name: 2-[4-[(2-fluorophenyl)methyl]-1-piperazinyl]-N-(3-methoxypropyl)acetamide
IUPAC NAME: 2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-N-(3-methoxypropyl)acetamide
SYSTEMATIC NAME: 2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-N-(3-methoxypropyl)ethanamide
MOLECULAR FORMULA: C17H26FN3O2
MOLECULAR WEIGHT: 323.405643
SMILES: COCCCNC(=O)CN1CCN(CC1)CC2=CC=CC=C2F
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Product OPENEYE NAME: N-(2-ethylphenyl)-2-[4-(tetrahydrofuran-2-ylmethyl)piperazin-1-yl]acetamide
CAS Name: N-(2-ethylphenyl)-2-[4-(2-oxolanylmethyl)-1-piperazinyl]acetamide
IUPAC NAME: N-(2-ethylphenyl)-2-[4-(oxolan-2-ylmethyl)piperazin-1-yl]acetamide
SYSTEMATIC NAME: N-(2-ethylphenyl)-2-[4-(oxolan-2-ylmethyl)piperazin-1-yl]ethanamide
MOLECULAR FORMULA: C19H29N3O2
MOLECULAR WEIGHT: 331.45246
SMILES: CCC1=CC=CC=C1NC(=O)CN2CCN(CC2)CC3CCCO3
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Product OPENEYE NAME: 1-[(E)-cinnamyl]-4-(tetrahydrofuran-2-ylmethyl)piperazine
CAS Name: 1-(2-oxolanylmethyl)-4-[(E)-3-phenylprop-2-enyl]piperazine
IUPAC NAME: 1-(oxolan-2-ylmethyl)-4-[(E)-3-phenylprop-2-enyl]piperazine
SYSTEMATIC NAME: 1-(oxolan-2-ylmethyl)-4-[(E)-3-phenylprop-2-enyl]piperazine
MOLECULAR FORMULA: C18H26N2O
MOLECULAR WEIGHT: 286.41184
SMILES: C1CC(OC1)CN2CCN(CC2)C/C=C/C3=CC=CC=C3
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Product OPENEYE NAME: 1-[(4-fluorophenyl)methyl]-4-(tetrahydrofuran-2-ylmethyl)piperazine
CAS Name: 1-[(4-fluorophenyl)methyl]-4-(2-oxolanylmethyl)piperazine
IUPAC NAME: 1-[(4-fluorophenyl)methyl]-4-(oxolan-2-ylmethyl)piperazine
SYSTEMATIC NAME: 1-[(4-fluorophenyl)methyl]-4-(oxolan-2-ylmethyl)piperazine
MOLECULAR FORMULA: C16H23FN2O
MOLECULAR WEIGHT: 278.365023
SMILES: C1CC(OC1)CN2CCN(CC2)CC3=CC=C(C=C3)F
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Product OPENEYE NAME: 2-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]-5-phenyl-1,3,4-oxadiazole
CAS Name: 2-[[2-(4-methoxyphenyl)-1-pyrrolidinyl]methyl]-5-phenyl-1,3,4-oxadiazole
IUPAC NAME: 2-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]-5-phenyl-1,3,4-oxadiazole
SYSTEMATIC NAME: 2-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]-5-phenyl-1,3,4-oxadiazole
MOLECULAR FORMULA: C20H21N3O2
MOLECULAR WEIGHT: 335.39964
SMILES: COC1=CC=C(C=C1)C2CCCN2CC3=NN=C(O3)C4=CC=CC=C4
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Product OPENEYE NAME: N-(3-cyano-2-thienyl)-2-[2-(4-methoxyphenyl)pyrrolidin-1-yl]acetamide
CAS Name: N-(3-cyano-2-thiophenyl)-2-[2-(4-methoxyphenyl)-1-pyrrolidinyl]acetamide
IUPAC NAME: N-(3-cyanothiophen-2-yl)-2-[2-(4-methoxyphenyl)pyrrolidin-1-yl]acetamide
SYSTEMATIC NAME: N-(3-cyanothiophen-2-yl)-2-[2-(4-methoxyphenyl)pyrrolidin-1-yl]ethanamide
MOLECULAR FORMULA: C18H19N3O2S
MOLECULAR WEIGHT: 341.42736
SMILES: COC1=CC=C(C=C1)C2CCCN2CC(=O)NC3=C(C=CS3)C#N
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Product OPENEYE NAME: 1-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N,N-dimethyl-piperidine-4-carboxamide
CAS Name: 1-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N,N-dimethyl-4-piperidinecarboxamide
IUPAC NAME: 1-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N,N-dimethylpiperidine-4-carboxamide
SYSTEMATIC NAME: 1-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N,N-dimethyl-piperidine-4-carboxamide
MOLECULAR FORMULA: C17H21ClN4O2
MOLECULAR WEIGHT: 348.82724
SMILES: CN(C)C(=O)C1CCN(CC1)CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl
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Product OPENEYE NAME: N,N-dimethyl-1-[(4-oxo-1H-quinazolin-2-yl)methyl]piperidine-4-carboxamide
CAS Name: N,N-dimethyl-1-[(4-oxo-1H-quinazolin-2-yl)methyl]-4-piperidinecarboxamide
IUPAC NAME: N,N-dimethyl-1-[(4-oxo-1H-quinazolin-2-yl)methyl]piperidine-4-carboxamide
SYSTEMATIC NAME: N,N-dimethyl-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]piperidine-4-carboxamide
MOLECULAR FORMULA: C17H22N4O2
MOLECULAR WEIGHT: 314.38218
SMILES: CN(C)C(=O)C1CCN(CC1)CC2=NC(=O)C3=CC=CC=C3N2
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Product OPENEYE NAME: 2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-isopropyl-acetamide
CAS Name: 2-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-N-propan-2-ylacetamide
IUPAC NAME: 2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-propan-2-ylacetamide
SYSTEMATIC NAME: 2-(4-cyclopropylcarbonylpiperazin-1-yl)-N-propan-2-yl-ethanamide
MOLECULAR FORMULA: C13H23N3O2
MOLECULAR WEIGHT: 253.34062
SMILES: CC(C)NC(=O)CN1CCN(CC1)C(=O)C2CC2
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Product OPENEYE NAME: 3-[2-[2-(2-thienyl)pyrrolidin-1-yl]ethylsulfonyl]propanamide
CAS Name: 3-[2-(2-thiophen-2-yl-1-pyrrolidinyl)ethylsulfonyl]propanamide
IUPAC NAME: 3-[2-(2-thiophen-2-ylpyrrolidin-1-yl)ethylsulfonyl]propanamide
SYSTEMATIC NAME: 3-[2-(2-thiophen-2-ylpyrrolidin-1-yl)ethylsulfonyl]propanamide
MOLECULAR FORMULA: C13H20N2O3S2
MOLECULAR WEIGHT: 316.4395
SMILES: C1CC(N(C1)CCS(=O)(=O)CCC(=O)N)C2=CC=CS2
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Product OPENEYE NAME: N-(2-furylmethyl)-N-methyl-2-[2-(2-thienyl)pyrrolidin-1-yl]acetamide
CAS Name: N-(2-furanylmethyl)-N-methyl-2-(2-thiophen-2-yl-1-pyrrolidinyl)acetamide
IUPAC NAME: N-(furan-2-ylmethyl)-N-methyl-2-(2-thiophen-2-ylpyrrolidin-1-yl)acetamide
SYSTEMATIC NAME: N-(furan-2-ylmethyl)-N-methyl-2-(2-thiophen-2-ylpyrrolidin-1-yl)ethanamide
MOLECULAR FORMULA: C16H20N2O2S
MOLECULAR WEIGHT: 304.4072
SMILES: CN(CC1=CC=CO1)C(=O)CN2CCCC2C3=CC=CS3
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Product OPENEYE NAME: 6-amino-1,3-dimethyl-5-[2-[2-(2-thienyl)pyrrolidin-1-yl]acetyl]pyrimidine-2,4-dione
CAS Name: 6-amino-1,3-dimethyl-5-[1-oxo-2-(2-thiophen-2-yl-1-pyrrolidinyl)ethyl]pyrimidine-2,4-dione
IUPAC NAME: 6-amino-1,3-dimethyl-5-[2-(2-thiophen-2-ylpyrrolidin-1-yl)acetyl]pyrimidine-2,4-dione
SYSTEMATIC NAME: 6-azanyl-1,3-dimethyl-5-[2-(2-thiophen-2-ylpyrrolidin-1-yl)ethanoyl]pyrimidine-2,4-dione
MOLECULAR FORMULA: C16H20N4O3S
MOLECULAR WEIGHT: 348.42
SMILES: CN1C(=C(C(=O)N(C1=O)C)C(=O)CN2CCCC2C3=CC=CS3)N
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Product OPENEYE NAME: (4Z)-2-bromo-6-methoxy-4-[(2Z)-2-(6-methoxy-3H-1,3-benzothiazol-2-ylidene)ethylidene]cyclohexa-2,5-dien-1-one
CAS Name: (4Z)-2-bromo-6-methoxy-4-[(2Z)-2-(6-methoxy-3H-1,3-benzothiazol-2-ylidene)ethylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: (4Z)-2-bromo-6-methoxy-4-[(2Z)-2-(6-methoxy-3H-1,3-benzothiazol-2-ylidene)ethylidene]cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: (4Z)-2-bromanyl-6-methoxy-4-[(2Z)-2-(6-methoxy-3H-1,3-benzothiazol-2-ylidene)ethylidene]cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C17H14BrNO3S
MOLECULAR WEIGHT: 392.26696
SMILES: COC1=CC2=C(C=C1)N/C(=C/C=C\3/C=C(C(=O)C(=C3)Br)OC)/S2
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