8-(4-chlorophenyl)-6-(phenylmethylsulfanyl)-7H-purine

Systemtic Name: 8-(4-chlorophenyl)-6-(phenylmethylsulfanyl)-7H-purine Openeye Name: 6-benzylsulfanyl-8-(4-chlorophenyl)-7H-purine CAS Name: 8-(4-chlorophenyl)-6-(phenylmethylthio)-7H-purine IUPAC Name: 6-benzylsulfanyl-8-(4-chlorophenyl)-7H-purine Traditional Name: 6-(benzylthio)-8-(4-chlorophenyl)-7H-purine Formula: C18H13ClN4S MolecularWeight: 352.84062

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC=NC3=C2NC(=N3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC=NC3=C2NC(=N3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H13ClN4S/c19-14-8-6-13(7-9-14)16-22-15-17(23-16)20-11-21-18(15)24-10-12-4-2-1-3-5-12/h1-9,11H,10H2,(H,20,21,22,23)