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

Systemtic Name: 2,3,6,7,10,11-hexakis(pentylsulfanyl)triphenylene Openeye Name: 2,3,6,7,10,11-hexakis(pentylsulfanyl)triphenylene CAS Name: 2,3,6,7,10,11-hexakis(pentylthio)triphenylene IUPAC Name: 2,3,6,7,10,11-hexakis(pentylsulfanyl)triphenylene Traditional Name: 2,3,6,7,10,11-hexakis(amylthio)triphenylene Formula: C48H72S6 MolecularWeight: 841.47528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)SCCCCC)SCCCCC)SCCCCC)SCCCCC)SCCCCC

Isomeric SMILES

CCCCCSC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)SCCCCC)SCCCCC)SCCCCC)SCCCCC)SCCCCC

InChI

InChI=1S/C48H72S6/c1-7-13-19-25-49-43-31-37-38(32-44(43)50-26-20-14-8-2)40-34-46(52-28-22-16-10-4)48(54-30-24-18-12-6)36-42(40)41-35-47(53-29-23-17-11-5)45(33-39(37)41)51-27-21-15-9-3/h31-36H,7-30H2,1-6H3