13-(4-sulfanylbutyl)-13-(10-sulfanyldecyl)octacosane-1,14,28-trithiol

Systemtic Name: 13-(4-sulfanylbutyl)-13-(10-sulfanyldecyl)octacosane-1,14,28-trithiol Openeye Name: 13-(4-sulfanylbutyl)-13-(10-sulfanyldecyl)octacosane-1,14,28-trithiol CAS Name: 13-(4-mercaptobutyl)-13-(10-mercaptodecyl)octacosane-1,14,28-trithiol IUPAC Name: 13-(4-sulfanylbutyl)-13-(10-sulfanyldecyl)octacosane-1,14,28-trithiol Traditional Name: 13-(4-mercaptobutyl)-13-(10-mercaptodecyl)octacosane-1,14,28-trithiol Formula: C42H86S5 MolecularWeight: 751.45724

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCCCCCS)CCCCCCC(C(CCCCCCCCCCCCS)(CCCCCCCCCCS)CCCCS)S

Isomeric SMILES

C(CCCCCCCS)CCCCCCC(C(CCCCCCCCCCCCS)(CCCCCCCCCCS)CCCCS)S

InChI

InChI=1S/C42H86S5/c43-37-29-22-16-10-5-2-1-3-7-13-19-25-33-41(47)42(36-28-32-40-46,35-27-21-15-9-12-18-24-31-39-45)34-26-20-14-8-4-6-11-17-23-30-38-44/h41,43-47H,1-40H2