4-methyl-2-(2-methyl-3-oxidanyl-3-oxidanylidene-propyl)sulfanyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 4-methyl-2-(2-methyl-3-oxidanyl-3-oxidanylidene-propyl)sulfanyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-(3-hydroxy-2-methyl-3-oxo-propyl)sulfanyl-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[(3-hydroxy-2-methyl-3-oxopropyl)thio]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-(3-hydroxy-2-methyl-3-oxopropyl)sulfanyl-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[(3-hydroxy-3-keto-2-methyl-propyl)thio]-4-methyl-thiazole-5-carboxylic acid Formula: C9H11NO4S2 MolecularWeight: 261.31794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)SCC(C)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)SCC(C)C(=O)O)C(=O)O

InChI

InChI=1S/C9H11NO4S2/c1-4(7(11)12)3-15-9-10-5(2)6(16-9)8(13)14/h4H,3H2,1-2H3,(H,11,12)(H,13,14)