Thursday, August 15, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 2-amino-5-[[(4-hydroxyphenyl)methylamino]methyl]pyrrolo[2,3-d]pyrimidin-4-one
CAS Name: 2-amino-5-[[(4-hydroxyphenyl)methylamino]methyl]-4-pyrrolo[2,3-d]pyrimidinone
IUPAC NAME: 2-amino-5-[[(4-hydroxyphenyl)methylamino]methyl]pyrrolo[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 2-azanyl-5-[[(4-hydroxyphenyl)methylamino]methyl]pyrrolo[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C14H13N5O2
MOLECULAR WEIGHT: 283.28532
SMILES: C1=CC(=CC=C1CNCC2=C3C(=NC(=NC3=O)N)N=C2)O
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Product OPENEYE NAME: 4-[[(2-amino-4-oxo-pyrrolo[2,3-d]pyrimidin-5-yl)methylamino]methyl]benzonitrile
CAS Name: 4-[[(2-amino-4-oxo-5-pyrrolo[2,3-d]pyrimidinyl)methylamino]methyl]benzonitrile
IUPAC NAME: 4-[[(2-amino-4-oxopyrrolo[2,3-d]pyrimidin-5-yl)methylamino]methyl]benzonitrile
SYSTEMATIC NAME: 4-[[(2-azanyl-4-oxidanylidene-pyrrolo[2,3-d]pyrimidin-5-yl)methylamino]methyl]benzenecarbonitrile
MOLECULAR FORMULA: C15H12N6O
MOLECULAR WEIGHT: 292.29538
SMILES: C1=CC(=CC=C1CNCC2=C3C(=NC(=NC3=O)N)N=C2)C#N
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Product OPENEYE NAME: 2-amino-5-[(cyclopentylamino)methyl]-3-(isopropoxymethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-one
CAS Name: 2-amino-5-[(cyclopentylamino)methyl]-3-(propan-2-yloxymethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-one
IUPAC NAME: 2-amino-5-[(cyclopentylamino)methyl]-3-(propan-2-yloxymethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 2-azanyl-5-[(cyclopentylamino)methyl]-3-(propan-2-yloxymethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C16H25N5O2
MOLECULAR WEIGHT: 319.402
SMILES: CC(C)OCN1C(=O)C2=C(NC=C2CNC3CCCC3)N=C1N
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Product OPENEYE NAME: 2-amino-5-[(cyclopentylamino)methyl]pyrrolo[2,3-d]pyrimidin-4-one
CAS Name: 2-amino-5-[(cyclopentylamino)methyl]-4-pyrrolo[2,3-d]pyrimidinone
IUPAC NAME: 2-amino-5-[(cyclopentylamino)methyl]pyrrolo[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 2-azanyl-5-[(cyclopentylamino)methyl]pyrrolo[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C12H15N5O
MOLECULAR WEIGHT: 245.2804
SMILES: C1CCC(C1)NCC2=C3C(=NC(=NC3=O)N)N=C2
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Product OPENEYE NAME: 2-amino-5-(propylaminomethyl)pyrrolo[2,3-d]pyrimidin-4-one
CAS Name: 2-amino-5-(propylaminomethyl)-4-pyrrolo[2,3-d]pyrimidinone
IUPAC NAME: 2-amino-5-(propylaminomethyl)pyrrolo[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 2-azanyl-5-(propylaminomethyl)pyrrolo[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C10H13N5O
MOLECULAR WEIGHT: 219.24312
SMILES: CCCNCC1=C2C(=NC(=NC2=O)N)N=C1
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Product OPENEYE NAME: 2-amino-5-[[(3-nitrophenyl)methylamino]methyl]pyrrolo[2,3-d]pyrimidin-4-one
CAS Name: 2-amino-5-[[(3-nitrophenyl)methylamino]methyl]-4-pyrrolo[2,3-d]pyrimidinone
IUPAC NAME: 2-amino-5-[[(3-nitrophenyl)methylamino]methyl]pyrrolo[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 2-azanyl-5-[[(3-nitrophenyl)methylamino]methyl]pyrrolo[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C14H12N6O3
MOLECULAR WEIGHT: 312.28348
SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])CNCC2=C3C(=NC(=NC3=O)N)N=C2
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Product OPENEYE NAME: 2-amino-5-[(benzylamino)methyl]pyrrolo[2,3-d]pyrimidin-4-one
CAS Name: 2-amino-5-[[(phenylmethyl)amino]methyl]-4-pyrrolo[2,3-d]pyrimidinone
IUPAC NAME: 2-amino-5-[(benzylamino)methyl]pyrrolo[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 2-azanyl-5-[[(phenylmethyl)amino]methyl]pyrrolo[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C14H13N5O
MOLECULAR WEIGHT: 267.28592
SMILES: C1=CC=C(C=C1)CNCC2=C3C(=NC(=NC3=O)N)N=C2
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Product OPENEYE NAME: N-[4-[[(2-amino-4-oxo-pyrrolo[2,3-d]pyrimidin-5-yl)methylamino]methyl]phenyl]acetamide
CAS Name: N-[4-[[(2-amino-4-oxo-5-pyrrolo[2,3-d]pyrimidinyl)methylamino]methyl]phenyl]acetamide
IUPAC NAME: N-[4-[[(2-amino-4-oxopyrrolo[2,3-d]pyrimidin-5-yl)methylamino]methyl]phenyl]acetamide
SYSTEMATIC NAME: N-[4-[[(2-azanyl-4-oxidanylidene-pyrrolo[2,3-d]pyrimidin-5-yl)methylamino]methyl]phenyl]ethanamide
MOLECULAR FORMULA: C16H16N6O2
MOLECULAR WEIGHT: 324.33724
SMILES: CC(=O)NC1=CC=C(C=C1)CNCC2=C3C(=NC(=NC3=O)N)N=C2
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Product OPENEYE NAME: 5-[(allylamino)methyl]-2-amino-pyrrolo[2,3-d]pyrimidin-4-one
CAS Name: 2-amino-5-[(prop-2-enylamino)methyl]-4-pyrrolo[2,3-d]pyrimidinone
IUPAC NAME: 2-amino-5-[(prop-2-enylamino)methyl]pyrrolo[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 2-azanyl-5-[(prop-2-enylamino)methyl]pyrrolo[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C10H11N5O
MOLECULAR WEIGHT: 217.22724
SMILES: C=CCNCC1=C2C(=NC(=NC2=O)N)N=C1
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Product OPENEYE NAME: 2-amino-5-(anilinomethyl)-7-benzyl-3-(isopropoxymethyl)pyrrolo[2,3-d]pyrimidin-4-one
CAS Name: 2-amino-5-(anilinomethyl)-7-(phenylmethyl)-3-(propan-2-yloxymethyl)-4-pyrrolo[2,3-d]pyrimidinone
IUPAC NAME: 2-amino-5-(anilinomethyl)-7-benzyl-3-(propan-2-yloxymethyl)pyrrolo[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 2-azanyl-5-(phenylazanylmethyl)-7-(phenylmethyl)-3-(propan-2-yloxymethyl)pyrrolo[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C24H27N5O2
MOLECULAR WEIGHT: 417.50348
SMILES: CC(C)OCN1C(=O)C2=C(N=C1N)N(C=C2CNC3=CC=CC=C3)CC4=CC=CC=C4
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Product OPENEYE NAME: 2-amino-5-[[(4-methoxyphenyl)methylamino]methyl]pyrrolo[2,3-d]pyrimidin-4-one
CAS Name: 2-amino-5-[[(4-methoxyphenyl)methylamino]methyl]-4-pyrrolo[2,3-d]pyrimidinone
IUPAC NAME: 2-amino-5-[[(4-methoxyphenyl)methylamino]methyl]pyrrolo[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 2-azanyl-5-[[(4-methoxyphenyl)methylamino]methyl]pyrrolo[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C15H15N5O2
MOLECULAR WEIGHT: 297.3119
SMILES: COC1=CC=C(C=C1)CNCC2=C3C(=NC(=NC3=O)N)N=C2
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Product OPENEYE NAME: 5-[[(4-acetylphenyl)methylamino]methyl]-2-amino-pyrrolo[2,3-d]pyrimidin-4-one
CAS Name: 5-[[(4-acetylphenyl)methylamino]methyl]-2-amino-4-pyrrolo[2,3-d]pyrimidinone
IUPAC NAME: 5-[[(4-acetylphenyl)methylamino]methyl]-2-aminopyrrolo[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 2-azanyl-5-[[(4-ethanoylphenyl)methylamino]methyl]pyrrolo[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C16H15N5O2
MOLECULAR WEIGHT: 309.3226
SMILES: CC(=O)C1=CC=C(C=C1)CNCC2=C3C(=NC(=NC3=O)N)N=C2
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Product OPENEYE NAME: 5-(1-piperidylmethyl)pyrrolo[2,3-d]pyrimidin-4-one
CAS Name: 5-(1-piperidinylmethyl)-4-pyrrolo[2,3-d]pyrimidinone
IUPAC NAME: 5-(piperidin-1-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 5-(piperidin-1-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C12H14N4O
MOLECULAR WEIGHT: 230.26576
SMILES: C1CCN(CC1)CC2=C3C(=NC=NC3=O)N=C2
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Product OPENEYE NAME: 2-amino-5-(1-piperidylmethyl)pyrrolo[2,3-d]pyrimidin-4-one
CAS Name: 2-amino-5-(1-piperidinylmethyl)-4-pyrrolo[2,3-d]pyrimidinone
IUPAC NAME: 2-amino-5-(piperidin-1-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 2-azanyl-5-(piperidin-1-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C12H15N5O
MOLECULAR WEIGHT: 245.2804
SMILES: C1CCN(CC1)CC2=C3C(=NC(=NC3=O)N)N=C2
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Product OPENEYE NAME: isopropyl 4-[[(2-amino-4-oxo-pyrrolo[2,3-d]pyrimidin-5-yl)methylamino]methyl]benzoate
CAS Name: 4-[[(2-amino-4-oxo-5-pyrrolo[2,3-d]pyrimidinyl)methylamino]methyl]benzoic acid propan-2-yl ester
IUPAC NAME: propan-2-yl 4-[[(2-amino-4-oxopyrrolo[2,3-d]pyrimidin-5-yl)methylamino]methyl]benzoate
SYSTEMATIC NAME: propan-2-yl 4-[[(2-azanyl-4-oxidanylidene-pyrrolo[2,3-d]pyrimidin-5-yl)methylamino]methyl]benzoate
MOLECULAR FORMULA: C18H19N5O3
MOLECULAR WEIGHT: 353.37516
SMILES: CC(C)OC(=O)C1=CC=C(C=C1)CNCC2=C3C(=NC(=NC3=O)N)N=C2
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Product OPENEYE NAME: 2-amino-5-(anilinomethyl)-3-(isopropoxymethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-one
CAS Name: 2-amino-5-(anilinomethyl)-3-(propan-2-yloxymethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-one
IUPAC NAME: 2-amino-5-(anilinomethyl)-3-(propan-2-yloxymethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 2-azanyl-5-(phenylazanylmethyl)-3-(propan-2-yloxymethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C17H21N5O2
MOLECULAR WEIGHT: 327.38094
SMILES: CC(C)OCN1C(=O)C2=C(NC=C2CNC3=CC=CC=C3)N=C1N
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Product OPENEYE NAME: 2-amino-5-[[[2-(diethylamino)-1-methyl-ethyl]amino]methyl]pyrrolo[2,3-d]pyrimidin-4-one
CAS Name: 2-amino-5-[[1-(diethylamino)propan-2-ylamino]methyl]-4-pyrrolo[2,3-d]pyrimidinone
IUPAC NAME: 2-amino-5-[[1-(diethylamino)propan-2-ylamino]methyl]pyrrolo[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 2-azanyl-5-[[1-(diethylamino)propan-2-ylamino]methyl]pyrrolo[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C14H22N6O
MOLECULAR WEIGHT: 290.36408
SMILES: CCN(CC)CC(C)NCC1=C2C(=NC(=NC2=O)N)N=C1
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Product OPENEYE NAME: 2-amino-5-[(cyclohex-2-en-1-ylamino)methyl]pyrrolo[2,3-d]pyrimidin-4-one
CAS Name: 2-amino-5-[(1-cyclohex-2-enylamino)methyl]-4-pyrrolo[2,3-d]pyrimidinone
IUPAC NAME: 2-amino-5-[(cyclohex-2-en-1-ylamino)methyl]pyrrolo[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 2-azanyl-5-[(cyclohex-2-en-1-ylamino)methyl]pyrrolo[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C13H15N5O
MOLECULAR WEIGHT: 257.2911
SMILES: C1CC=CC(C1)NCC2=C3C(=NC(=NC3=O)N)N=C2
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Product OPENEYE NAME: 2-amino-5-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyrrolo[2,3-d]pyrimidin-4-one
CAS Name: 2-amino-5-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]-4-pyrrolo[2,3-d]pyrimidinone
IUPAC NAME: 2-amino-5-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyrrolo[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 2-azanyl-5-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyrrolo[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C15H12F3N5O
MOLECULAR WEIGHT: 335.28389
SMILES: C1=CC(=CC=C1CNCC2=C3C(=NC(=NC3=O)N)N=C2)C(F)(F)F
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