2-chloranyl-1-ethyl-8-methyl-9-(phenylmethyl)purin-6-one

Systemtic Name: 2-chloranyl-1-ethyl-8-methyl-9-(phenylmethyl)purin-6-one Openeye Name: 9-benzyl-2-chloro-1-ethyl-8-methyl-purin-6-one CAS Name: 2-chloro-1-ethyl-8-methyl-9-(phenylmethyl)-6-purinone IUPAC Name: 9-benzyl-2-chloro-1-ethyl-8-methylpurin-6-one Traditional Name: 9-benzyl-2-chloro-1-ethyl-8-methyl-purin-6-one Formula: C15H15ClN4O MolecularWeight: 302.7588

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1Cl)N(C(=N2)C)CC3=CC=CC=C3

Isomeric SMILES

CCN1C(=O)C2=C(N=C1Cl)N(C(=N2)C)CC3=CC=CC=C3

InChI

InChI=1S/C15H15ClN4O/c1-3-19-14(21)12-13(18-15(19)16)20(10(2)17-12)9-11-7-5-4-6-8-11/h4-8H,3,9H2,1-2H3