2-(4-methyl-1,3-thiazol-5-yl)-2-sulfanyl-butanoic acid

Systemtic Name: 2-(4-methyl-1,3-thiazol-5-yl)-2-sulfanyl-butanoic acid Openeye Name: 2-(4-methylthiazol-5-yl)-2-sulfanyl-butanoic acid CAS Name: 2-mercapto-2-(4-methyl-5-thiazolyl)butanoic acid IUPAC Name: 2-(4-methyl-1,3-thiazol-5-yl)-2-sulfanylbutanoic acid Traditional Name: 2-mercapto-2-(4-methylthiazol-5-yl)butyric acid Formula: C8H11NO2S2 MolecularWeight: 217.30844

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(N=CS1)C)(C(=O)O)S

Isomeric SMILES

CCC(C1=C(N=CS1)C)(C(=O)O)S

InChI

InChI=1S/C8H11NO2S2/c1-3-8(12,7(10)11)6-5(2)9-4-13-6/h4,12H,3H2,1-2H3,(H,10,11)