9-(phenylmethyl)-6-(phenylmethylsulfanyl)purin-2-amine

Systemtic Name: 9-(phenylmethyl)-6-(phenylmethylsulfanyl)purin-2-amine Openeye Name: 9-benzyl-6-benzylsulfanyl-purin-2-amine CAS Name: 9-(phenylmethyl)-6-(phenylmethylthio)-2-purinamine IUPAC Name: 9-benzyl-6-benzylsulfanylpurin-2-amine Traditional Name: [9-benzyl-6-(benzylthio)purin-2-yl]amine Formula: C19H17N5S MolecularWeight: 347.43678

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C2N=C(N=C3SCC4=CC=CC=C4)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C2N=C(N=C3SCC4=CC=CC=C4)N

InChI

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