2-(2-methyl-1,3-thiazol-4-yl)-3-oxidanylidene-butanoic acid

Systemtic Name: 2-(2-methyl-1,3-thiazol-4-yl)-3-oxidanylidene-butanoic acid Openeye Name: 2-(2-methylthiazol-4-yl)-3-oxo-butanoic acid CAS Name: 2-(2-methyl-4-thiazolyl)-3-oxobutanoic acid IUPAC Name: 2-(2-methyl-1,3-thiazol-4-yl)-3-oxobutanoic acid Traditional Name: 3-keto-2-(2-methylthiazol-4-yl)butyric acid Formula: C8H9NO3S MolecularWeight: 199.22696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C(C(=O)C)C(=O)O

Isomeric SMILES

CC1=NC(=CS1)C(C(=O)C)C(=O)O

InChI

InChI=1S/C8H9NO3S/c1-4(10)7(8(11)12)6-3-13-5(2)9-6/h3,7H,1-2H3,(H,11,12)