1,2,3,4,5,6-hexakis(phenylmethylsulfanyl)benzene

Systemtic Name: 1,2,3,4,5,6-hexakis(phenylmethylsulfanyl)benzene Openeye Name: 1,2,3,4,5,6-hexakis(benzylsulfanyl)benzene CAS Name: 1,2,3,4,5,6-hexakis(phenylmethylthio)benzene IUPAC Name: 1,2,3,4,5,6-hexakis(benzylsulfanyl)benzene Traditional Name: 1,2,3,4,5,6-hexakis(benzylthio)benzene Formula: C48H42S6 MolecularWeight: 811.23708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(C(=C(C(=C2SCC3=CC=CC=C3)SCC4=CC=CC=C4)SCC5=CC=CC=C5)SCC6=CC=CC=C6)SCC7=CC=CC=C7

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(C(=C(C(=C2SCC3=CC=CC=C3)SCC4=CC=CC=C4)SCC5=CC=CC=C5)SCC6=CC=CC=C6)SCC7=CC=CC=C7

InChI

InChI=1S/C48H42S6/c1-7-19-37(20-8-1)31-49-43-44(50-32-38-21-9-2-10-22-38)46(52-34-40-25-13-4-14-26-40)48(54-36-42-29-17-6-18-30-42)47(53-35-41-27-15-5-16-28-41)45(43)51-33-39-23-11-3-12-24-39/h1-30H,31-36H2