7-(phenylmethyl)-2-pyridin-4-yl-3H-purin-6-one

Systemtic Name: 7-(phenylmethyl)-2-pyridin-4-yl-3H-purin-6-one Openeye Name: 7-benzyl-2-(4-pyridyl)-3H-purin-6-one CAS Name: 7-(phenylmethyl)-2-pyridin-4-yl-3H-purin-6-one IUPAC Name: 7-benzyl-2-pyridin-4-yl-3H-purin-6-one Traditional Name: 7-benzyl-2-(4-pyridyl)-3H-purin-6-one Formula: C17H13N5O MolecularWeight: 303.31802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C2C(=O)N=C(N3)C4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C2C(=O)N=C(N3)C4=CC=NC=C4

InChI

InChI=1S/C17H13N5O/c23-17-14-16(20-15(21-17)13-6-8-18-9-7-13)19-11-22(14)10-12-4-2-1-3-5-12/h1-9,11H,10H2,(H,20,21,23)