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

Systemtic Name: 2-methyl-7-(phenylmethyl)-3H-purin-6-one Openeye Name: 7-benzyl-2-methyl-3H-purin-6-one CAS Name: 2-methyl-7-(phenylmethyl)-3H-purin-6-one IUPAC Name: 7-benzyl-2-methyl-3H-purin-6-one Traditional Name: 7-benzyl-2-methyl-3H-purin-6-one Formula: C13H12N4O MolecularWeight: 240.26058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C2=C(N1)N=CN2CC3=CC=CC=C3

Isomeric SMILES

CC1=NC(=O)C2=C(N1)N=CN2CC3=CC=CC=C3

InChI

InChI=1S/C13H12N4O/c1-9-15-12-11(13(18)16-9)17(8-14-12)7-10-5-3-2-4-6-10/h2-6,8H,7H2,1H3,(H,15,16,18)