7-methyl-6-methylsulfanyl-8-phenyl-3H-purin-2-one

Systemtic Name: 7-methyl-6-methylsulfanyl-8-phenyl-3H-purin-2-one Openeye Name: 7-methyl-6-methylsulfanyl-8-phenyl-3H-purin-2-one CAS Name: 7-methyl-6-(methylthio)-8-phenyl-3H-purin-2-one IUPAC Name: 7-methyl-6-methylsulfanyl-8-phenyl-3H-purin-2-one Traditional Name: 7-methyl-6-(methylthio)-8-phenyl-3H-purin-2-one Formula: C13H12N4OS MolecularWeight: 272.32558

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(NC(=O)N=C2SC)N=C1C3=CC=CC=C3

Isomeric SMILES

CN1C2=C(NC(=O)N=C2SC)N=C1C3=CC=CC=C3

InChI

InChI=1S/C13H12N4OS/c1-17-9-10(15-13(18)16-12(9)19-2)14-11(17)8-6-4-3-5-7-8/h3-7H,1-2H3,(H,15,16,18)