9,10-bis(2-sulfanylethylamino)octadecanoic acid

Systemtic Name: 9,10-bis(2-sulfanylethylamino)octadecanoic acid Openeye Name: 9,10-bis(2-sulfanylethylamino)octadecanoic acid CAS Name: 9,10-bis(2-mercaptoethylamino)octadecanoic acid IUPAC Name: 9,10-bis(2-sulfanylethylamino)octadecanoic acid Traditional Name: 9,10-bis(2-mercaptoethylamino)stearic acid Formula: C22H46N2O2S2 MolecularWeight: 434.74284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C(CCCCCCCC(=O)O)NCCS)NCCS

Isomeric SMILES

CCCCCCCCC(C(CCCCCCCC(=O)O)NCCS)NCCS

InChI

InChI=1S/C22H46N2O2S2/c1-2-3-4-5-7-10-13-20(23-16-18-27)21(24-17-19-28)14-11-8-6-9-12-15-22(25)26/h20-21,23-24,27-28H,2-19H2,1H3,(H,25,26)