3-(phenylmethyl)-6-(phenylmethylsulfanyl)purine

Systemtic Name: 3-(phenylmethyl)-6-(phenylmethylsulfanyl)purine Openeye Name: 3-benzyl-6-benzylsulfanyl-purine CAS Name: 3-(phenylmethyl)-6-(phenylmethylthio)purine IUPAC Name: 3-benzyl-6-benzylsulfanylpurine Traditional Name: 3-benzyl-6-(benzylthio)purine Formula: C19H16N4S MolecularWeight: 332.42214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC(=C3C2=NC=N3)SCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC(=C3C2=NC=N3)SCC4=CC=CC=C4

InChI

InChI=1S/C19H16N4S/c1-3-7-15(8-4-1)11-23-14-22-19(17-18(23)21-13-20-17)24-12-16-9-5-2-6-10-16/h1-10,13-14H,11-12H2