2,3,6,7,10,11-hexakis(decylsulfanyl)triphenylene

Systemtic Name: 2,3,6,7,10,11-hexakis(decylsulfanyl)triphenylene Openeye Name: 2,3,6,7,10,11-hexakis(decylsulfanyl)triphenylene CAS Name: 2,3,6,7,10,11-hexakis(decylthio)triphenylene IUPAC Name: 2,3,6,7,10,11-hexakis(decylsulfanyl)triphenylene Traditional Name: 2,3,6,7,10,11-hexakis(decylthio)triphenylene Formula: C78H132S6 MolecularWeight: 1262.27268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)SCCCCCCCCCC)SCCCCCCCCCC)SCCCCCCCCCC)SCCCCCCCCCC)SCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCSC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)SCCCCCCCCCC)SCCCCCCCCCC)SCCCCCCCCCC)SCCCCCCCCCC)SCCCCCCCCCC

InChI

InChI=1S/C78H132S6/c1-7-13-19-25-31-37-43-49-55-79-73-61-67-68(62-74(73)80-56-50-44-38-32-26-20-14-8-2)70-64-76(82-58-52-46-40-34-28-22-16-10-4)78(84-60-54-48-42-36-30-24-18-12-6)66-72(70)71-65-77(83-59-53-47-41-35-29-23-17-11-5)75(63-69(67)71)81-57-51-45-39-33-27-21-15-9-3/h61-66H,7-60H2,1-6H3