2,3,6,7,10-pentakis(hexylsulfanyl)-11-(6-methylhept-6-enylsulfanyl)triphenylene

Systemtic Name: 2,3,6,7,10-pentakis(hexylsulfanyl)-11-(6-methylhept-6-enylsulfanyl)triphenylene Openeye Name: 2,3,6,7,10-pentakis(hexylsulfanyl)-11-(6-methylhept-6-enylsulfanyl)triphenylene CAS Name: 2,3,6,7,10-pentakis(hexylthio)-11-(6-methylhept-6-enylthio)triphenylene IUPAC Name: 2,3,6,7,10-pentakis(hexylsulfanyl)-11-(6-methylhept-6-enylsulfanyl)triphenylene Traditional Name: 2,3,6,7,10-pentakis(hexylthio)-11-(6-methylhept-6-enylthio)triphenylene Formula: C56H86S6 MolecularWeight: 951.67204

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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)SCCCCCC(=C)C)SCCCCCC)SCCCCCC)SCCCCCC

Isomeric SMILES

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

InChI

InChI=1S/C56H86S6/c1-8-13-18-25-32-57-51-38-45-46-39-52(58-33-26-19-14-9-2)54(60-35-28-21-16-11-4)41-48(46)50-43-56(62-37-30-23-24-31-44(6)7)55(61-36-29-22-17-12-5)42-49(50)47(45)40-53(51)59-34-27-20-15-10-3/h38-43H,6,8-37H2,1-5,7H3