3-(phenylmethyl)-8-(phenylmethylsulfanyl)purin-6-amine

Systemtic Name: 3-(phenylmethyl)-8-(phenylmethylsulfanyl)purin-6-amine Openeye Name: 3-benzyl-8-benzylsulfanyl-purin-6-amine CAS Name: 3-(phenylmethyl)-8-(phenylmethylthio)-6-purinamine IUPAC Name: 3-benzyl-8-benzylsulfanylpurin-6-amine Traditional Name: [3-benzyl-8-(benzylthio)purin-6-yl]amine Formula: C19H17N5S MolecularWeight: 347.43678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17N5S/c20-17-16-18(24(13-21-17)11-14-7-3-1-4-8-14)23-19(22-16)25-12-15-9-5-2-6-10-15/h1-10,13H,11-12,20H2