6-[3,6,7,10,11-pentakis(hexylsulfanyl)triphenylen-2-yl]sulfanylhexan-1-ol

Systemtic Name: 6-[3,6,7,10,11-pentakis(hexylsulfanyl)triphenylen-2-yl]sulfanylhexan-1-ol Openeye Name: 6-[3,6,7,10,11-pentakis(hexylsulfanyl)triphenylen-2-yl]sulfanylhexan-1-ol CAS Name: 6-[[3,6,7,10,11-pentakis(hexylthio)-2-triphenylenyl]thio]-1-hexanol IUPAC Name: 6-[3,6,7,10,11-pentakis(hexylsulfanyl)triphenylen-2-yl]sulfanylhexan-1-ol Traditional Name: 6-[[3,6,7,10,11-pentakis(hexylthio)triphenylen-2-yl]thio]hexan-1-ol Formula: C54H84OS6 MolecularWeight: 941.63416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)SCCCCCC)SCCCCCCO)SCCCCCC)SCCCCCC)SCCCCCC

Isomeric SMILES

CCCCCCSC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)SCCCCCC)SCCCCCCO)SCCCCCC)SCCCCCC)SCCCCCC

InChI

InChI=1S/C54H84OS6/c1-6-11-16-24-31-56-49-37-43-44-38-50(57-32-25-17-12-7-2)52(59-34-27-19-14-9-4)40-46(44)48-42-54(61-36-29-22-21-23-30-55)53(60-35-28-20-15-10-5)41-47(48)45(43)39-51(49)58-33-26-18-13-8-3/h37-42,55H,6-36H2,1-5H3