(2-azanyl-4-methylsulfanyl-butanoyl) hexadecanoate

Systemtic Name: (2-azanyl-4-methylsulfanyl-butanoyl) hexadecanoate Openeye Name: (2-amino-4-methylsulfanyl-butanoyl) hexadecanoate CAS Name: hexadecanoic acid [2-amino-4-(methylthio)-1-oxobutyl] ester IUPAC Name: (2-amino-4-methylsulfanylbutanoyl) hexadecanoate Traditional Name: palmitic acid [2-amino-4-(methylthio)butanoyl] ester Formula: C21H41NO3S MolecularWeight: 387.62014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC(=O)C(CCSC)N

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC(=O)C(CCSC)N

InChI

InChI=1S/C21H41NO3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20(23)25-21(24)19(22)17-18-26-2/h19H,3-18,22H2,1-2H3