2-(1-dodecylsulfanyltridecyl)-2-(sulfanylmethyl)propane-1,3-diol

Systemtic Name: 2-(1-dodecylsulfanyltridecyl)-2-(sulfanylmethyl)propane-1,3-diol Openeye Name: 2-(1-dodecylsulfanyltridecyl)-2-(sulfanylmethyl)propane-1,3-diol CAS Name: 2-[1-(dodecylthio)tridecyl]-2-(mercaptomethyl)propane-1,3-diol IUPAC Name: 2-(1-dodecylsulfanyltridecyl)-2-(sulfanylmethyl)propane-1,3-diol Traditional Name: 2-[1-(laurylthio)tridecyl]-2-(mercaptomethyl)propane-1,3-diol Formula: C29H60O2S2 MolecularWeight: 504.9155

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C(CO)(CO)CS)SCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCC(C(CO)(CO)CS)SCCCCCCCCCCCC

InChI

InChI=1S/C29H60O2S2/c1-3-5-7-9-11-13-15-17-19-21-23-28(29(25-30,26-31)27-32)33-24-22-20-18-16-14-12-10-8-6-4-2/h28,30-32H,3-27H2,1-2H3