2,3,6,7,10-pentakis(hexylsulfanyl)-11-(4-methylpent-4-enylsulfanyl)triphenylene

Systemtic Name: 2,3,6,7,10-pentakis(hexylsulfanyl)-11-(4-methylpent-4-enylsulfanyl)triphenylene Openeye Name: 2,3,6,7,10-pentakis(hexylsulfanyl)-11-(4-methylpent-4-enylsulfanyl)triphenylene CAS Name: 2,3,6,7,10-pentakis(hexylthio)-11-(4-methylpent-4-enylthio)triphenylene IUPAC Name: 2,3,6,7,10-pentakis(hexylsulfanyl)-11-(4-methylpent-4-enylsulfanyl)triphenylene Traditional Name: 2,3,6,7,10-pentakis(hexylthio)-11-(4-methylpent-4-enylthio)triphenylene Formula: C54H82S6 MolecularWeight: 923.61888

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

Isomeric SMILES

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

InChI

InChI=1S/C54H82S6/c1-8-13-18-23-30-55-49-36-43-44-37-50(56-31-24-19-14-9-2)52(58-33-26-21-16-11-4)39-46(44)48-41-54(60-35-28-29-42(6)7)53(59-34-27-22-17-12-5)40-47(48)45(43)38-51(49)57-32-25-20-15-10-3/h36-41H,6,8-35H2,1-5,7H3