2-chloranyl-8-(cyclopropylmethyl)-1-methyl-7-(phenylmethyl)purin-6-one

Systemtic Name: 2-chloranyl-8-(cyclopropylmethyl)-1-methyl-7-(phenylmethyl)purin-6-one Openeye Name: 7-benzyl-2-chloro-8-(cyclopropylmethyl)-1-methyl-purin-6-one CAS Name: 2-chloro-8-(cyclopropylmethyl)-1-methyl-7-(phenylmethyl)-6-purinone IUPAC Name: 7-benzyl-2-chloro-8-(cyclopropylmethyl)-1-methylpurin-6-one Traditional Name: 7-benzyl-2-chloro-8-(cyclopropylmethyl)-1-methyl-purin-6-one Formula: C17H17ClN4O MolecularWeight: 328.79608

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C(N2CC3=CC=CC=C3)CC4CC4)N=C1Cl

Isomeric SMILES

CN1C(=O)C2=C(N=C(N2CC3=CC=CC=C3)CC4CC4)N=C1Cl

InChI

InChI=1S/C17H17ClN4O/c1-21-16(23)14-15(20-17(21)18)19-13(9-11-7-8-11)22(14)10-12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3