6-azanyl-9-methyl-7-(phenylmethyl)purin-8-one

Systemtic Name: 6-azanyl-9-methyl-7-(phenylmethyl)purin-8-one Openeye Name: 6-amino-7-benzyl-9-methyl-purin-8-one CAS Name: 6-amino-9-methyl-7-(phenylmethyl)-8-purinone IUPAC Name: 6-amino-7-benzyl-9-methylpurin-8-one Traditional Name: 6-amino-7-benzyl-9-methyl-purin-8-one Formula: C13H13N5O MolecularWeight: 255.27522

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=NC=N2)N)N(C1=O)CC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C(=NC=N2)N)N(C1=O)CC3=CC=CC=C3

InChI

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