2-[3-oxidanylidenebutanoyl(sulfanyl)amino]propanoic acid

Systemtic Name: 2-[3-oxidanylidenebutanoyl(sulfanyl)amino]propanoic acid Openeye Name: 2-[3-oxobutanoyl(sulfanyl)amino]propanoic acid CAS Name: 2-[1,3-dioxobutyl(mercapto)amino]propanoic acid IUPAC Name: 2-[3-oxobutanoyl(sulfanyl)amino]propanoic acid Traditional Name: 2-[acetoacetyl(mercapto)amino]propionic acid Formula: C7H11NO4S MolecularWeight: 205.23154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(C(=O)CC(=O)C)S

Isomeric SMILES

CC(C(=O)O)N(C(=O)CC(=O)C)S

InChI

InChI=1S/C7H11NO4S/c1-4(9)3-6(10)8(13)5(2)7(11)12/h5,13H,3H2,1-2H3,(H,11,12)