2-(hexadecanoylamino)-4-sulfanyl-butanoic acid

Systemtic Name: 2-(hexadecanoylamino)-4-sulfanyl-butanoic acid Openeye Name: 2-(hexadecanoylamino)-4-sulfanyl-butanoic acid CAS Name: 4-mercapto-2-(1-oxohexadecylamino)butanoic acid IUPAC Name: 2-(hexadecanoylamino)-4-sulfanylbutanoic acid Traditional Name: 4-mercapto-2-palmitamido-butyric acid Formula: C20H39NO3S MolecularWeight: 373.59356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC(CCS)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC(CCS)C(=O)O

InChI

InChI=1S/C20H39NO3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(22)21-18(16-17-25)20(23)24/h18,25H,2-17H2,1H3,(H,21,22)(H,23,24)