Friday, April 27, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 7-[(2-chlorophenyl)methyl]-3-methyl-8-[(2S)-2-methyl-1-piperidyl]purine-2,6-dione
CAS Name: 7-[(2-chlorophenyl)methyl]-3-methyl-8-[(2S)-2-methyl-1-piperidinyl]purine-2,6-dione
IUPAC NAME: 7-[(2-chlorophenyl)methyl]-3-methyl-8-[(2S)-2-methylpiperidin-1-yl]purine-2,6-dione
SYSTEMATIC NAME: 7-[(2-chlorophenyl)methyl]-3-methyl-8-[(2S)-2-methylpiperidin-1-yl]purine-2,6-dione
MOLECULAR FORMULA: C19H22ClN5O2
MOLECULAR WEIGHT: 387.86328
SMILES: C[C@H]1CCCCN1C2=NC3=C(N2CC4=CC=CC=C4Cl)C(=O)NC(=O)N3C
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Product OPENEYE NAME: 7-[(2-chlorophenyl)methyl]-3-methyl-8-[(2R)-2-methyl-1-piperidyl]purine-2,6-dione
CAS Name: 7-[(2-chlorophenyl)methyl]-3-methyl-8-[(2R)-2-methyl-1-piperidinyl]purine-2,6-dione
IUPAC NAME: 7-[(2-chlorophenyl)methyl]-3-methyl-8-[(2R)-2-methylpiperidin-1-yl]purine-2,6-dione
SYSTEMATIC NAME: 7-[(2-chlorophenyl)methyl]-3-methyl-8-[(2R)-2-methylpiperidin-1-yl]purine-2,6-dione
MOLECULAR FORMULA: C19H22ClN5O2
MOLECULAR WEIGHT: 387.86328
SMILES: C[C@@H]1CCCCN1C2=NC3=C(N2CC4=CC=CC=C4Cl)C(=O)NC(=O)N3C
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Product OPENEYE NAME: 3-methyl-8-[(2S)-2-methyl-1-piperidyl]-7-(3-phenylpropyl)purine-2,6-dione
CAS Name: 3-methyl-8-[(2S)-2-methyl-1-piperidinyl]-7-(3-phenylpropyl)purine-2,6-dione
IUPAC NAME: 3-methyl-8-[(2S)-2-methylpiperidin-1-yl]-7-(3-phenylpropyl)purine-2,6-dione
SYSTEMATIC NAME: 3-methyl-8-[(2S)-2-methylpiperidin-1-yl]-7-(3-phenylpropyl)purine-2,6-dione
MOLECULAR FORMULA: C21H27N5O2
MOLECULAR WEIGHT: 381.47138
SMILES: C[C@H]1CCCCN1C2=NC3=C(N2CCCC4=CC=CC=C4)C(=O)NC(=O)N3C
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Product OPENEYE NAME: 3-methyl-8-[(2R)-2-methyl-1-piperidyl]-7-(3-phenylpropyl)purine-2,6-dione
CAS Name: 3-methyl-8-[(2R)-2-methyl-1-piperidinyl]-7-(3-phenylpropyl)purine-2,6-dione
IUPAC NAME: 3-methyl-8-[(2R)-2-methylpiperidin-1-yl]-7-(3-phenylpropyl)purine-2,6-dione
SYSTEMATIC NAME: 3-methyl-8-[(2R)-2-methylpiperidin-1-yl]-7-(3-phenylpropyl)purine-2,6-dione
MOLECULAR FORMULA: C21H27N5O2
MOLECULAR WEIGHT: 381.47138
SMILES: C[C@@H]1CCCCN1C2=NC3=C(N2CCCC4=CC=CC=C4)C(=O)NC(=O)N3C
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Product OPENEYE NAME: 8-(cyclopentylamino)-3-methyl-7-(3-phenylpropyl)purine-2,6-dione
CAS Name: 8-(cyclopentylamino)-3-methyl-7-(3-phenylpropyl)purine-2,6-dione
IUPAC NAME: 8-(cyclopentylamino)-3-methyl-7-(3-phenylpropyl)purine-2,6-dione
SYSTEMATIC NAME: 8-(cyclopentylamino)-3-methyl-7-(3-phenylpropyl)purine-2,6-dione
MOLECULAR FORMULA: C20H25N5O2
MOLECULAR WEIGHT: 367.4448
SMILES: CN1C2=C(C(=O)NC1=O)N(C(=N2)NC3CCCC3)CCCC4=CC=CC=C4
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Product OPENEYE NAME: 7-allyl-8-[4-(3-chlorophenyl)piperazin-1-yl]-3-methyl-purine-2,6-dione
CAS Name: 8-[4-(3-chlorophenyl)-1-piperazinyl]-3-methyl-7-prop-2-enylpurine-2,6-dione
IUPAC NAME: 8-[4-(3-chlorophenyl)piperazin-1-yl]-3-methyl-7-prop-2-enylpurine-2,6-dione
SYSTEMATIC NAME: 8-[4-(3-chlorophenyl)piperazin-1-yl]-3-methyl-7-prop-2-enyl-purine-2,6-dione
MOLECULAR FORMULA: C19H21ClN6O2
MOLECULAR WEIGHT: 400.86204
SMILES: CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCN(CC3)C4=CC(=CC=C4)Cl)CC=C
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Product OPENEYE NAME: 7-benzyl-1,3-dimethyl-8-[(3S)-3-methyl-1-piperidyl]purine-2,6-dione
CAS Name: 1,3-dimethyl-8-[(3S)-3-methyl-1-piperidinyl]-7-(phenylmethyl)purine-2,6-dione
IUPAC NAME: 7-benzyl-1,3-dimethyl-8-[(3S)-3-methylpiperidin-1-yl]purine-2,6-dione
SYSTEMATIC NAME: 1,3-dimethyl-8-[(3S)-3-methylpiperidin-1-yl]-7-(phenylmethyl)purine-2,6-dione
MOLECULAR FORMULA: C20H25N5O2
MOLECULAR WEIGHT: 367.4448
SMILES: C[C@H]1CCCN(C1)C2=NC3=C(N2CC4=CC=CC=C4)C(=O)N(C(=O)N3C)C
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Product OPENEYE NAME: 7-benzyl-1,3-dimethyl-8-[(3R)-3-methyl-1-piperidyl]purine-2,6-dione
CAS Name: 1,3-dimethyl-8-[(3R)-3-methyl-1-piperidinyl]-7-(phenylmethyl)purine-2,6-dione
IUPAC NAME: 7-benzyl-1,3-dimethyl-8-[(3R)-3-methylpiperidin-1-yl]purine-2,6-dione
SYSTEMATIC NAME: 1,3-dimethyl-8-[(3R)-3-methylpiperidin-1-yl]-7-(phenylmethyl)purine-2,6-dione
MOLECULAR FORMULA: C20H25N5O2
MOLECULAR WEIGHT: 367.4448
SMILES: C[C@@H]1CCCN(C1)C2=NC3=C(N2CC4=CC=CC=C4)C(=O)N(C(=O)N3C)C
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Product OPENEYE NAME: 8-[[benzyl(methyl)amino]methyl]-1,3-dimethyl-7-[(1S)-1-methyl-2-oxo-propyl]purine-2,6-dione
CAS Name: 1,3-dimethyl-8-[[methyl-(phenylmethyl)amino]methyl]-7-[(2S)-3-oxobutan-2-yl]purine-2,6-dione
IUPAC NAME: 8-[[benzyl(methyl)amino]methyl]-1,3-dimethyl-7-[(2S)-3-oxobutan-2-yl]purine-2,6-dione
SYSTEMATIC NAME: 1,3-dimethyl-8-[[methyl-(phenylmethyl)amino]methyl]-7-[(2S)-3-oxidanylidenebutan-2-yl]purine-2,6-dione
MOLECULAR FORMULA: C20H25N5O3
MOLECULAR WEIGHT: 383.4442
SMILES: C[C@@H](C(=O)C)N1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN(C)CC3=CC=CC=C3
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Product OPENEYE NAME: 8-[[benzyl(methyl)amino]methyl]-1,3-dimethyl-7-[(1R)-1-methyl-2-oxo-propyl]purine-2,6-dione
CAS Name: 1,3-dimethyl-8-[[methyl-(phenylmethyl)amino]methyl]-7-[(2R)-3-oxobutan-2-yl]purine-2,6-dione
IUPAC NAME: 8-[[benzyl(methyl)amino]methyl]-1,3-dimethyl-7-[(2R)-3-oxobutan-2-yl]purine-2,6-dione
SYSTEMATIC NAME: 1,3-dimethyl-8-[[methyl-(phenylmethyl)amino]methyl]-7-[(2R)-3-oxidanylidenebutan-2-yl]purine-2,6-dione
MOLECULAR FORMULA: C20H25N5O3
MOLECULAR WEIGHT: 383.4442
SMILES: C[C@H](C(=O)C)N1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN(C)CC3=CC=CC=C3
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Product OPENEYE NAME: 8-[(4-ethylpiperazin-1-yl)methyl]-1,3-dimethyl-7-[(1S)-1-methyl-2-oxo-propyl]purine-2,6-dione
CAS Name: 8-[(4-ethyl-1-piperazinyl)methyl]-1,3-dimethyl-7-[(2S)-3-oxobutan-2-yl]purine-2,6-dione
IUPAC NAME: 8-[(4-ethylpiperazin-1-yl)methyl]-1,3-dimethyl-7-[(2S)-3-oxobutan-2-yl]purine-2,6-dione
SYSTEMATIC NAME: 8-[(4-ethylpiperazin-1-yl)methyl]-1,3-dimethyl-7-[(2S)-3-oxidanylidenebutan-2-yl]purine-2,6-dione
MOLECULAR FORMULA: C18H28N6O3
MOLECULAR WEIGHT: 376.45332
SMILES: CCN1CCN(CC1)CC2=NC3=C(N2[C@@H](C)C(=O)C)C(=O)N(C(=O)N3C)C
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Product OPENEYE NAME: 8-[(4-ethylpiperazin-1-yl)methyl]-1,3-dimethyl-7-[(1R)-1-methyl-2-oxo-propyl]purine-2,6-dione
CAS Name: 8-[(4-ethyl-1-piperazinyl)methyl]-1,3-dimethyl-7-[(2R)-3-oxobutan-2-yl]purine-2,6-dione
IUPAC NAME: 8-[(4-ethylpiperazin-1-yl)methyl]-1,3-dimethyl-7-[(2R)-3-oxobutan-2-yl]purine-2,6-dione
SYSTEMATIC NAME: 8-[(4-ethylpiperazin-1-yl)methyl]-1,3-dimethyl-7-[(2R)-3-oxidanylidenebutan-2-yl]purine-2,6-dione
MOLECULAR FORMULA: C18H28N6O3
MOLECULAR WEIGHT: 376.45332
SMILES: CCN1CCN(CC1)CC2=NC3=C(N2[C@H](C)C(=O)C)C(=O)N(C(=O)N3C)C
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Product OPENEYE NAME: 1,3-dimethyl-7-[(1S)-1-methyl-2-oxo-propyl]-8-[[(2R)-2-methyl-1-piperidyl]methyl]purine-2,6-dione
CAS Name: 1,3-dimethyl-8-[[(2R)-2-methyl-1-piperidinyl]methyl]-7-[(2S)-3-oxobutan-2-yl]purine-2,6-dione
IUPAC NAME: 1,3-dimethyl-8-[[(2R)-2-methylpiperidin-1-yl]methyl]-7-[(2S)-3-oxobutan-2-yl]purine-2,6-dione
SYSTEMATIC NAME: 1,3-dimethyl-8-[[(2R)-2-methylpiperidin-1-yl]methyl]-7-[(2S)-3-oxidanylidenebutan-2-yl]purine-2,6-dione
MOLECULAR FORMULA: C18H27N5O3
MOLECULAR WEIGHT: 361.43868
SMILES: C[C@@H]1CCCCN1CC2=NC3=C(N2[C@@H](C)C(=O)C)C(=O)N(C(=O)N3C)C
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Product OPENEYE NAME: 1,3-dimethyl-7-[(1S)-1-methyl-2-oxo-propyl]-8-[(4-methyl-1-piperidyl)methyl]purine-2,6-dione
CAS Name: 1,3-dimethyl-8-[(4-methyl-1-piperidinyl)methyl]-7-[(2S)-3-oxobutan-2-yl]purine-2,6-dione
IUPAC NAME: 1,3-dimethyl-8-[(4-methylpiperidin-1-yl)methyl]-7-[(2S)-3-oxobutan-2-yl]purine-2,6-dione
SYSTEMATIC NAME: 1,3-dimethyl-8-[(4-methylpiperidin-1-yl)methyl]-7-[(2S)-3-oxidanylidenebutan-2-yl]purine-2,6-dione
MOLECULAR FORMULA: C18H27N5O3
MOLECULAR WEIGHT: 361.43868
SMILES: CC1CCN(CC1)CC2=NC3=C(N2[C@@H](C)C(=O)C)C(=O)N(C(=O)N3C)C
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Product OPENEYE NAME: 1,3-dimethyl-7-[(1R)-1-methyl-2-oxo-propyl]-8-[(4-methyl-1-piperidyl)methyl]purine-2,6-dione
CAS Name: 1,3-dimethyl-8-[(4-methyl-1-piperidinyl)methyl]-7-[(2R)-3-oxobutan-2-yl]purine-2,6-dione
IUPAC NAME: 1,3-dimethyl-8-[(4-methylpiperidin-1-yl)methyl]-7-[(2R)-3-oxobutan-2-yl]purine-2,6-dione
SYSTEMATIC NAME: 1,3-dimethyl-8-[(4-methylpiperidin-1-yl)methyl]-7-[(2R)-3-oxidanylidenebutan-2-yl]purine-2,6-dione
MOLECULAR FORMULA: C18H27N5O3
MOLECULAR WEIGHT: 361.43868
SMILES: CC1CCN(CC1)CC2=NC3=C(N2[C@H](C)C(=O)C)C(=O)N(C(=O)N3C)C
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Product OPENEYE NAME: 1,3-dimethyl-7-(2-pyrimidin-2-ylsulfanylethyl)-8-pyrrolidin-1-yl-purine-2,6-dione
CAS Name: 1,3-dimethyl-7-[2-(2-pyrimidinylthio)ethyl]-8-(1-pyrrolidinyl)purine-2,6-dione
IUPAC NAME: 1,3-dimethyl-7-(2-pyrimidin-2-ylsulfanylethyl)-8-pyrrolidin-1-ylpurine-2,6-dione
SYSTEMATIC NAME: 1,3-dimethyl-7-(2-pyrimidin-2-ylsulfanylethyl)-8-pyrrolidin-1-yl-purine-2,6-dione
MOLECULAR FORMULA: C17H21N7O2S
MOLECULAR WEIGHT: 387.45934
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCCC3)CCSC4=NC=CC=N4
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Product OPENEYE NAME: 1,3-dimethyl-8-(1-piperidyl)-7-(2-pyrimidin-2-ylsulfanylethyl)purine-2,6-dione
CAS Name: 1,3-dimethyl-8-(1-piperidinyl)-7-[2-(2-pyrimidinylthio)ethyl]purine-2,6-dione
IUPAC NAME: 1,3-dimethyl-8-piperidin-1-yl-7-(2-pyrimidin-2-ylsulfanylethyl)purine-2,6-dione
SYSTEMATIC NAME: 1,3-dimethyl-8-piperidin-1-yl-7-(2-pyrimidin-2-ylsulfanylethyl)purine-2,6-dione
MOLECULAR FORMULA: C18H23N7O2S
MOLECULAR WEIGHT: 401.48592
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCCCC3)CCSC4=NC=CC=N4
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Product OPENEYE NAME: 7-allyl-1,3-dimethyl-8-[(3S)-3-methyl-1-piperidyl]purine-2,6-dione
CAS Name: 1,3-dimethyl-8-[(3S)-3-methyl-1-piperidinyl]-7-prop-2-enylpurine-2,6-dione
IUPAC NAME: 1,3-dimethyl-8-[(3S)-3-methylpiperidin-1-yl]-7-prop-2-enylpurine-2,6-dione
SYSTEMATIC NAME: 1,3-dimethyl-8-[(3S)-3-methylpiperidin-1-yl]-7-prop-2-enyl-purine-2,6-dione
MOLECULAR FORMULA: C16H23N5O2
MOLECULAR WEIGHT: 317.38612
SMILES: C[C@H]1CCCN(C1)C2=NC3=C(N2CC=C)C(=O)N(C(=O)N3C)C
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Product OPENEYE NAME: 7-allyl-1,3-dimethyl-8-[(3R)-3-methyl-1-piperidyl]purine-2,6-dione
CAS Name: 1,3-dimethyl-8-[(3R)-3-methyl-1-piperidinyl]-7-prop-2-enylpurine-2,6-dione
IUPAC NAME: 1,3-dimethyl-8-[(3R)-3-methylpiperidin-1-yl]-7-prop-2-enylpurine-2,6-dione
SYSTEMATIC NAME: 1,3-dimethyl-8-[(3R)-3-methylpiperidin-1-yl]-7-prop-2-enyl-purine-2,6-dione
MOLECULAR FORMULA: C16H23N5O2
MOLECULAR WEIGHT: 317.38612
SMILES: C[C@@H]1CCCN(C1)C2=NC3=C(N2CC=C)C(=O)N(C(=O)N3C)C
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Product OPENEYE NAME: 1,3-dimethyl-7-(2-methylallyl)-8-[(3S)-3-methyl-1-piperidyl]purine-2,6-dione
CAS Name: 1,3-dimethyl-8-[(3S)-3-methyl-1-piperidinyl]-7-(2-methylprop-2-enyl)purine-2,6-dione
IUPAC NAME: 1,3-dimethyl-8-[(3S)-3-methylpiperidin-1-yl]-7-(2-methylprop-2-enyl)purine-2,6-dione
SYSTEMATIC NAME: 1,3-dimethyl-8-[(3S)-3-methylpiperidin-1-yl]-7-(2-methylprop-2-enyl)purine-2,6-dione
MOLECULAR FORMULA: C17H25N5O2
MOLECULAR WEIGHT: 331.4127
SMILES: C[C@H]1CCCN(C1)C2=NC3=C(N2CC(=C)C)C(=O)N(C(=O)N3C)C
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