2-[(4-azanyl-5-phenyl-pyrrolo[2,3-d]pyrimidin-7-yl)methyl]propane-1,3-diol

Systemtic Name: 2-[(4-azanyl-5-phenyl-pyrrolo[2,3-d]pyrimidin-7-yl)methyl]propane-1,3-diol Openeye Name: 2-[(4-amino-5-phenyl-pyrrolo[2,3-d]pyrimidin-7-yl)methyl]propane-1,3-diol CAS Name: 2-[(4-amino-5-phenyl-7-pyrrolo[2,3-d]pyrimidinyl)methyl]propane-1,3-diol IUPAC Name: 2-[(4-amino-5-phenylpyrrolo[2,3-d]pyrimidin-7-yl)methyl]propane-1,3-diol Traditional Name: 2-[(4-amino-5-phenyl-pyrrolo[2,3-d]pyrimidin-7-yl)methyl]propane-1,3-diol Formula: C16H18N4O2 MolecularWeight: 298.33972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(C3=C2C(=NC=N3)N)CC(CO)CO

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(C3=C2C(=NC=N3)N)CC(CO)CO

InChI

InChI=1S/C16H18N4O2/c17-15-14-13(12-4-2-1-3-5-12)7-20(6-11(8-21)9-22)16(14)19-10-18-15/h1-5,7,10-11,21-22H,6,8-9H2,(H2,17,18,19)