2-(12-phenyldodecylsulfanylmethyl)-2-(sulfanylmethyl)propane-1,3-diol

Systemtic Name: 2-(12-phenyldodecylsulfanylmethyl)-2-(sulfanylmethyl)propane-1,3-diol Openeye Name: 2-(12-phenyldodecylsulfanylmethyl)-2-(sulfanylmethyl)propane-1,3-diol CAS Name: 2-(mercaptomethyl)-2-[(12-phenyldodecylthio)methyl]propane-1,3-diol IUPAC Name: 2-(12-phenyldodecylsulfanylmethyl)-2-(sulfanylmethyl)propane-1,3-diol Traditional Name: 2-(mercaptomethyl)-2-[(12-phenyldodecylthio)methyl]propane-1,3-diol Formula: C23H40O2S2 MolecularWeight: 412.6925

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCCCCCCCSCC(CO)(CO)CS

Isomeric SMILES

C1=CC=C(C=C1)CCCCCCCCCCCCSCC(CO)(CO)CS

InChI

InChI=1S/C23H40O2S2/c24-18-23(19-25,20-26)21-27-17-13-8-6-4-2-1-3-5-7-10-14-22-15-11-9-12-16-22/h9,11-12,15-16,24-26H,1-8,10,13-14,17-21H2