[2-hexadecanoyloxy-3-(2-tetradecylsulfanylethanoylamino)propyl] hexadecanoate

Systemtic Name: [2-hexadecanoyloxy-3-(2-tetradecylsulfanylethanoylamino)propyl] hexadecanoate Openeye Name: [2-hexadecanoyloxy-3-[(2-tetradecylsulfanylacetyl)amino]propyl] hexadecanoate CAS Name: hexadecanoic acid [2-(1-oxohexadecoxy)-3-[[1-oxo-2-(tetradecylthio)ethyl]amino]propyl] ester IUPAC Name: [2-hexadecanoyloxy-3-[(2-tetradecylsulfanylacetyl)amino]propyl] hexadecanoate Traditional Name: palmitic acid [2-hexadecanoyloxy-3-[[2-(myristylthio)acetyl]amino]propyl] ester Formula: C51H99NO5S MolecularWeight: 838.40046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(CNC(=O)CSCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC(CNC(=O)CSCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C51H99NO5S/c1-4-7-10-13-16-19-22-25-27-30-33-36-39-42-50(54)56-46-48(57-51(55)43-40-37-34-31-28-26-23-20-17-14-11-8-5-2)45-52-49(53)47-58-44-41-38-35-32-29-24-21-18-15-12-9-6-3/h48H,4-47H2,1-3H3,(H,52,53)