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

Systemtic Name: 2-[2-(4-azanyl-5-phenyl-pyrrolo[2,3-d]pyrimidin-7-yl)ethyl]propane-1,3-diol Openeye Name: 2-[2-(4-amino-5-phenyl-pyrrolo[2,3-d]pyrimidin-7-yl)ethyl]propane-1,3-diol CAS Name: 2-[2-(4-amino-5-phenyl-7-pyrrolo[2,3-d]pyrimidinyl)ethyl]propane-1,3-diol IUPAC Name: 2-[2-(4-amino-5-phenylpyrrolo[2,3-d]pyrimidin-7-yl)ethyl]propane-1,3-diol Traditional Name: 2-[2-(4-amino-5-phenyl-pyrrolo[2,3-d]pyrimidin-7-yl)ethyl]propane-1,3-diol Formula: C17H20N4O2 MolecularWeight: 312.3663

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N4O2/c18-16-15-14(13-4-2-1-3-5-13)8-21(17(15)20-11-19-16)7-6-12(9-22)10-23/h1-5,8,11-12,22-23H,6-7,9-10H2,(H2,18,19,20)