2-(methylamino)-7-(phenylmethyl)-3H-purin-6-one

Systemtic Name: 2-(methylamino)-7-(phenylmethyl)-3H-purin-6-one Openeye Name: 7-benzyl-2-(methylamino)-3H-purin-6-one CAS Name: 2-(methylamino)-7-(phenylmethyl)-3H-purin-6-one IUPAC Name: 7-benzyl-2-(methylamino)-3H-purin-6-one Traditional Name: 7-benzyl-2-(methylamino)-3H-purin-6-one Formula: C13H13N5O MolecularWeight: 255.27522

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=O)C2=C(N1)N=CN2CC3=CC=CC=C3

Isomeric SMILES

CNC1=NC(=O)C2=C(N1)N=CN2CC3=CC=CC=C3

InChI

InChI=1S/C13H13N5O/c1-14-13-16-11-10(12(19)17-13)18(8-15-11)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H2,14,16,17,19)