6-[ethanoyl(methyl)amino]-2-(ethanoylsulfanylmethyl)hexanoic acid

Systemtic Name: 6-[ethanoyl(methyl)amino]-2-(ethanoylsulfanylmethyl)hexanoic acid Openeye Name: 6-[acetyl(methyl)amino]-2-(acetylsulfanylmethyl)hexanoic acid CAS Name: 6-[acetyl(methyl)amino]-2-[(acetylthio)methyl]hexanoic acid IUPAC Name: 6-[acetyl(methyl)amino]-2-(acetylsulfanylmethyl)hexanoic acid Traditional Name: 6-[acetyl(methyl)amino]-2-[(acetylthio)methyl]hexanoic acid Formula: C12H21NO4S MolecularWeight: 275.36444

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C)CCCCC(CSC(=O)C)C(=O)O

Isomeric SMILES

CC(=O)N(C)CCCCC(CSC(=O)C)C(=O)O

InChI

InChI=1S/C12H21NO4S/c1-9(14)13(3)7-5-4-6-11(12(16)17)8-18-10(2)15/h11H,4-8H2,1-3H3,(H,16,17)