8-(3-methoxyphenyl)-7-methyl-6-(phenylmethylsulfanyl)purine

Systemtic Name: 8-(3-methoxyphenyl)-7-methyl-6-(phenylmethylsulfanyl)purine Openeye Name: 6-benzylsulfanyl-8-(3-methoxyphenyl)-7-methyl-purine CAS Name: 8-(3-methoxyphenyl)-7-methyl-6-(phenylmethylthio)purine IUPAC Name: 6-benzylsulfanyl-8-(3-methoxyphenyl)-7-methylpurine Traditional Name: 6-(benzylthio)-8-(3-methoxyphenyl)-7-methyl-purine Formula: C20H18N4OS MolecularWeight: 362.44812

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=CN=C2SCC3=CC=CC=C3)N=C1C4=CC(=CC=C4)OC

Isomeric SMILES

CN1C2=C(N=CN=C2SCC3=CC=CC=C3)N=C1C4=CC(=CC=C4)OC

InChI

InChI=1S/C20H18N4OS/c1-24-17-18(23-19(24)15-9-6-10-16(11-15)25-2)21-13-22-20(17)26-12-14-7-4-3-5-8-14/h3-11,13H,12H2,1-2H3