2-azanyl-3-oxidanylidene-2-(sulfanylmethyl)hexanoic acid

Systemtic Name: 2-azanyl-3-oxidanylidene-2-(sulfanylmethyl)hexanoic acid Openeye Name: 2-amino-3-oxo-2-(sulfanylmethyl)hexanoic acid CAS Name: 2-amino-2-(mercaptomethyl)-3-oxohexanoic acid IUPAC Name: 2-amino-3-oxo-2-(sulfanylmethyl)hexanoic acid Traditional Name: 2-amino-3-keto-2-(mercaptomethyl)hexanoic acid Formula: C7H13NO3S MolecularWeight: 191.24802

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(CS)(C(=O)O)N

Isomeric SMILES

CCCC(=O)C(CS)(C(=O)O)N

InChI

InChI=1S/C7H13NO3S/c1-2-3-5(9)7(8,4-12)6(10)11/h12H,2-4,8H2,1H3,(H,10,11)