6-azanyl-1-methyl-7-(phenylmethyl)purin-2-one

Systemtic Name: 6-azanyl-1-methyl-7-(phenylmethyl)purin-2-one Openeye Name: 6-amino-7-benzyl-1-methyl-purin-2-one CAS Name: 6-amino-1-methyl-7-(phenylmethyl)-2-purinone IUPAC Name: 6-amino-7-benzyl-1-methylpurin-2-one Traditional Name: 6-amino-7-benzyl-1-methyl-purin-2-one Formula: C13H13N5O MolecularWeight: 255.27522

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C2C(=NC1=O)N=CN2CC3=CC=CC=C3)N

Isomeric SMILES

CN1C(=C2C(=NC1=O)N=CN2CC3=CC=CC=C3)N

InChI

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