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

Systemtic Name: 2-chloranyl-1-methyl-7-(phenylmethyl)purin-6-one Openeye Name: 7-benzyl-2-chloro-1-methyl-purin-6-one CAS Name: 2-chloro-1-methyl-7-(phenylmethyl)-6-purinone IUPAC Name: 7-benzyl-2-chloro-1-methylpurin-6-one Traditional Name: 7-benzyl-2-chloro-1-methyl-purin-6-one Formula: C13H11ClN4O MolecularWeight: 274.70564

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=CN2CC3=CC=CC=C3)N=C1Cl

Isomeric SMILES

CN1C(=O)C2=C(N=CN2CC3=CC=CC=C3)N=C1Cl

InChI

InChI=1S/C13H11ClN4O/c1-17-12(19)10-11(16-13(17)14)15-8-18(10)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3