7-methyl-6-methylsulfanyl-3-(phenylmethyl)purin-2-one

Systemtic Name: 7-methyl-6-methylsulfanyl-3-(phenylmethyl)purin-2-one Openeye Name: 3-benzyl-7-methyl-6-methylsulfanyl-purin-2-one CAS Name: 7-methyl-6-(methylthio)-3-(phenylmethyl)-2-purinone IUPAC Name: 3-benzyl-7-methyl-6-methylsulfanylpurin-2-one Traditional Name: 3-benzyl-7-methyl-6-(methylthio)purin-2-one Formula: C14H14N4OS MolecularWeight: 286.35216

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=NC(=O)N2CC3=CC=CC=C3)SC

Isomeric SMILES

CN1C=NC2=C1C(=NC(=O)N2CC3=CC=CC=C3)SC

InChI

InChI=1S/C14H14N4OS/c1-17-9-15-12-11(17)13(20-2)16-14(19)18(12)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3