Tuesday, January 29, 2013

All Chemical Compounds Information




Product OPENEYE NAME: N-[(5-chloro-2-thienyl)methyl]-N-methyl-thiophene-2-carboxamide
CAS Name: N-[(5-chloro-2-thiophenyl)methyl]-N-methyl-2-thiophenecarboxamide
IUPAC NAME: N-[(5-chlorothiophen-2-yl)methyl]-N-methylthiophene-2-carboxamide
SYSTEMATIC NAME: N-[(5-chloranylthiophen-2-yl)methyl]-N-methyl-thiophene-2-carboxamide
MOLECULAR FORMULA: C11H10ClNOS2
MOLECULAR WEIGHT: 271.7862
SMILES: CN(CC1=CC=C(S1)Cl)C(=O)C2=CC=CS2
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Product OPENEYE NAME: 3-[(2,4-dimethylphenyl)sulfonylamino]-N-prop-2-ynyl-propanamide
CAS Name: 3-[(2,4-dimethylphenyl)sulfonylamino]-N-prop-2-ynylpropanamide
IUPAC NAME: 3-[(2,4-dimethylphenyl)sulfonylamino]-N-prop-2-ynylpropanamide
SYSTEMATIC NAME: 3-[(2,4-dimethylphenyl)sulfonylamino]-N-prop-2-ynyl-propanamide
MOLECULAR FORMULA: C14H18N2O3S
MOLECULAR WEIGHT: 294.36932
SMILES: CC1=CC(=C(C=C1)S(=O)(=O)NCCC(=O)NCC#C)C
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Product OPENEYE NAME: N-prop-2-ynyl-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide
CAS Name: 1-(4-methylphenyl)sulfonyl-N-prop-2-ynyl-2-pyrrolidinecarboxamide
IUPAC NAME: 1-(4-methylphenyl)sulfonyl-N-prop-2-ynylpyrrolidine-2-carboxamide
SYSTEMATIC NAME: 1-(4-methylphenyl)sulfonyl-N-prop-2-ynyl-pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C15H18N2O3S
MOLECULAR WEIGHT: 306.38002
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NCC#C
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Product OPENEYE NAME: 4-isopropoxy-3-methoxy-N-prop-2-ynyl-benzamide
CAS Name: 3-methoxy-4-propan-2-yloxy-N-prop-2-ynylbenzamide
IUPAC NAME: 3-methoxy-4-propan-2-yloxy-N-prop-2-ynylbenzamide
SYSTEMATIC NAME: 3-methoxy-4-propan-2-yloxy-N-prop-2-ynyl-benzamide
MOLECULAR FORMULA: C14H17NO3
MOLECULAR WEIGHT: 247.28968
SMILES: CC(C)OC1=C(C=C(C=C1)C(=O)NCC#C)OC
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Product OPENEYE NAME: 2-chloro-5-morpholinosulfonyl-N-prop-2-ynyl-benzamide
CAS Name: 2-chloro-5-(4-morpholinylsulfonyl)-N-prop-2-ynylbenzamide
IUPAC NAME: 2-chloro-5-morpholin-4-ylsulfonyl-N-prop-2-ynylbenzamide
SYSTEMATIC NAME: 2-chloranyl-5-morpholin-4-ylsulfonyl-N-prop-2-ynyl-benzamide
MOLECULAR FORMULA: C14H15ClN2O4S
MOLECULAR WEIGHT: 342.7979
SMILES: C#CCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)Cl
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C14H14N2O3
MOLECULAR WEIGHT: 258.27256
SMILES: C#CCNC(=O)CN1C(=O)C2C3CC(C2C1=O)C=C3
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Product OPENEYE NAME: N-prop-2-ynyl-2-(2-thienylmethylsulfanyl)acetamide
CAS Name: N-prop-2-ynyl-2-(thiophen-2-ylmethylthio)acetamide
IUPAC NAME: N-prop-2-ynyl-2-(thiophen-2-ylmethylsulfanyl)acetamide
SYSTEMATIC NAME: N-prop-2-ynyl-2-(thiophen-2-ylmethylsulfanyl)ethanamide
MOLECULAR FORMULA: C10H11NOS2
MOLECULAR WEIGHT: 225.33044
SMILES: C#CCNC(=O)CSCC1=CC=CS1
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Product OPENEYE NAME: 2-(4-oxothiazolidin-3-yl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetamide
CAS Name: 2-(4-oxo-3-thiazolidinyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetamide
IUPAC NAME: 2-(4-oxo-1,3-thiazolidin-3-yl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetamide
SYSTEMATIC NAME: 2-(4-oxidanylidene-1,3-thiazolidin-3-yl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)ethanamide
MOLECULAR FORMULA: C10H14N4O2S2
MOLECULAR WEIGHT: 286.37376
SMILES: CCCC1=NN=C(S1)NC(=O)CN2CSCC2=O
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Product OPENEYE NAME: 4-tert-butyl-N-[3-methylsulfanyl-1-(prop-2-ynylcarbamoyl)propyl]benzamide
CAS Name: 4-tert-butyl-N-[4-(methylthio)-1-oxo-1-(prop-2-ynylamino)butan-2-yl]benzamide
IUPAC NAME: 4-tert-butyl-N-[4-methylsulfanyl-1-oxo-1-(prop-2-ynylamino)butan-2-yl]benzamide
SYSTEMATIC NAME: 4-tert-butyl-N-[4-methylsulfanyl-1-oxidanylidene-1-(prop-2-ynylamino)butan-2-yl]benzamide
MOLECULAR FORMULA: C19H26N2O2S
MOLECULAR WEIGHT: 346.48694
SMILES: CC(C)(C)C1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)NCC#C
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Product OPENEYE NAME: 1-(2,3-dihydrobenzofuran-5-ylsulfonyl)-4-methyl-piperazine
CAS Name: 1-(2,3-dihydrobenzofuran-5-ylsulfonyl)-4-methylpiperazine
IUPAC NAME: 1-(2,3-dihydro-1-benzofuran-5-ylsulfonyl)-4-methylpiperazine
SYSTEMATIC NAME: 1-(2,3-dihydro-1-benzofuran-5-ylsulfonyl)-4-methyl-piperazine
MOLECULAR FORMULA: C13H18N2O3S
MOLECULAR WEIGHT: 282.35862
SMILES: CN1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OCC3
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Product OPENEYE NAME: 4-(2,3-dihydrobenzofuran-5-ylsulfonylamino)benzoic acid
CAS Name: 4-(2,3-dihydrobenzofuran-5-ylsulfonylamino)benzoic acid
IUPAC NAME: 4-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)benzoic acid
SYSTEMATIC NAME: 4-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)benzoic acid
MOLECULAR FORMULA: C15H13NO5S
MOLECULAR WEIGHT: 319.33242
SMILES: C1COC2=C1C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)C(=O)O
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Product OPENEYE NAME: N-(2-morpholinoethyl)-2,3-dihydrobenzofuran-5-sulfonamide
CAS Name: N-[2-(4-morpholinyl)ethyl]-2,3-dihydrobenzofuran-5-sulfonamide
IUPAC NAME: N-(2-morpholin-4-ylethyl)-2,3-dihydro-1-benzofuran-5-sulfonamide
SYSTEMATIC NAME: N-(2-morpholin-4-ylethyl)-2,3-dihydro-1-benzofuran-5-sulfonamide
MOLECULAR FORMULA: C14H20N2O4S
MOLECULAR WEIGHT: 312.3846
SMILES: C1COC2=C1C=C(C=C2)S(=O)(=O)NCCN3CCOCC3
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Product OPENEYE NAME: 2-(2-allyl-4-methoxy-phenoxy)-N-(5-methylisoxazol-3-yl)acetamide
CAS Name: 2-(4-methoxy-2-prop-2-enylphenoxy)-N-(5-methyl-3-isoxazolyl)acetamide
IUPAC NAME: 2-(4-methoxy-2-prop-2-enylphenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
SYSTEMATIC NAME: 2-(4-methoxy-2-prop-2-enyl-phenoxy)-N-(5-methyl-1,2-oxazol-3-yl)ethanamide
MOLECULAR FORMULA: C16H18N2O4
MOLECULAR WEIGHT: 302.32512
SMILES: CC1=CC(=NO1)NC(=O)COC2=C(C=C(C=C2)OC)CC=C
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Product OPENEYE NAME: 9-methyl-2-(1-piperidylmethyl)pyrido[1,2-a]pyrimidin-4-one
CAS Name: 9-methyl-2-(1-piperidinylmethyl)-4-pyrido[1,2-a]pyrimidinone
IUPAC NAME: 9-methyl-2-(piperidin-1-ylmethyl)pyrido[1,2-a]pyrimidin-4-one
SYSTEMATIC NAME: 9-methyl-2-(piperidin-1-ylmethyl)pyrido[1,2-a]pyrimidin-4-one
MOLECULAR FORMULA: C15H19N3O
MOLECULAR WEIGHT: 257.33086
SMILES: CC1=CC=CN2C1=NC(=CC2=O)CN3CCCCC3
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Product OPENEYE NAME: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-9-methyl-pyrido[1,2-a]pyrimidin-4-one
CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-9-methyl-4-pyrido[1,2-a]pyrimidinone
IUPAC NAME: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-9-methylpyrido[1,2-a]pyrimidin-4-one
SYSTEMATIC NAME: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-9-methyl-pyrido[1,2-a]pyrimidin-4-one
MOLECULAR FORMULA: C19H19N3O
MOLECULAR WEIGHT: 305.37366
SMILES: CC1=CC=CN2C1=NC(=CC2=O)CN3CCC4=CC=CC=C4C3
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Product OPENEYE NAME: 2-[(2,6-dimethylmorpholin-4-yl)methyl]-9-methyl-pyrido[1,2-a]pyrimidin-4-one
CAS Name: 2-[(2,6-dimethyl-4-morpholinyl)methyl]-9-methyl-4-pyrido[1,2-a]pyrimidinone
IUPAC NAME: 2-[(2,6-dimethylmorpholin-4-yl)methyl]-9-methylpyrido[1,2-a]pyrimidin-4-one
SYSTEMATIC NAME: 2-[(2,6-dimethylmorpholin-4-yl)methyl]-9-methyl-pyrido[1,2-a]pyrimidin-4-one
MOLECULAR FORMULA: C16H21N3O2
MOLECULAR WEIGHT: 287.35684
SMILES: CC1CN(CC(O1)C)CC2=CC(=O)N3C=CC=C(C3=N2)C
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Product OPENEYE NAME: 1-[5-(2-furyl)-3-(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-pyrrolidin-1-yl-ethanone
CAS Name: 1-[5-(2-furanyl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(1-pyrrolidinyl)ethanone
IUPAC NAME: 1-[5-(furan-2-yl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-pyrrolidin-1-ylethanone
SYSTEMATIC NAME: 1-[5-(furan-2-yl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-pyrrolidin-1-yl-ethanone
MOLECULAR FORMULA: C17H19N3O2S
MOLECULAR WEIGHT: 329.41666
SMILES: C1CCN(C1)CC(=O)N2C(CC(=N2)C3=CC=CO3)C4=CC=CS4
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Product OPENEYE NAME: 9-methyl-2-(morpholinomethyl)pyrido[1,2-a]pyrimidin-4-one
CAS Name: 9-methyl-2-(4-morpholinylmethyl)-4-pyrido[1,2-a]pyrimidinone
IUPAC NAME: 9-methyl-2-(morpholin-4-ylmethyl)pyrido[1,2-a]pyrimidin-4-one
SYSTEMATIC NAME: 9-methyl-2-(morpholin-4-ylmethyl)pyrido[1,2-a]pyrimidin-4-one
MOLECULAR FORMULA: C14H17N3O2
MOLECULAR WEIGHT: 259.30368
SMILES: CC1=CC=CN2C1=NC(=CC2=O)CN3CCOCC3
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Product OPENEYE NAME: 4-(4-allylpiperazin-1-yl)phenol
CAS Name: 4-(4-prop-2-enyl-1-piperazinyl)phenol
IUPAC NAME: 4-(4-prop-2-enylpiperazin-1-yl)phenol
SYSTEMATIC NAME: 4-(4-prop-2-enylpiperazin-1-yl)phenol
MOLECULAR FORMULA: C13H18N2O
MOLECULAR WEIGHT: 218.29482
SMILES: C=CCN1CCN(CC1)C2=CC=C(C=C2)O
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Product OPENEYE NAME: 2-(tert-butylamino)-1-[5-(2-furyl)-3-(2-thienyl)-3,4-dihydropyrazol-2-yl]ethanone
CAS Name: 2-(tert-butylamino)-1-[5-(2-furanyl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone
IUPAC NAME: 2-(tert-butylamino)-1-[5-(furan-2-yl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone
SYSTEMATIC NAME: 2-(tert-butylamino)-1-[5-(furan-2-yl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone
MOLECULAR FORMULA: C17H21N3O2S
MOLECULAR WEIGHT: 331.43254
SMILES: CC(C)(C)NCC(=O)N1C(CC(=N1)C2=CC=CO2)C3=CC=CS3
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Product OPENEYE NAME: 3-[4-(4-fluorophenyl)piperazin-1-yl]-N-(5-methylisoxazol-3-yl)propanamide
CAS Name: 3-[4-(4-fluorophenyl)-1-piperazinyl]-N-(5-methyl-3-isoxazolyl)propanamide
IUPAC NAME: 3-[4-(4-fluorophenyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
SYSTEMATIC NAME: 3-[4-(4-fluorophenyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
MOLECULAR FORMULA: C17H21FN4O2
MOLECULAR WEIGHT: 332.372643
SMILES: CC1=CC(=NO1)NC(=O)CCN2CCN(CC2)C3=CC=C(C=C3)F
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Product OPENEYE NAME: 2-(4-allylpiperazin-1-yl)pyrimidine
CAS Name: 2-(4-prop-2-enyl-1-piperazinyl)pyrimidine
IUPAC NAME: 2-(4-prop-2-enylpiperazin-1-yl)pyrimidine
SYSTEMATIC NAME: 2-(4-prop-2-enylpiperazin-1-yl)pyrimidine
MOLECULAR FORMULA: C11H16N4
MOLECULAR WEIGHT: 204.27154
SMILES: C=CCN1CCN(CC1)C2=NC=CC=N2
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