4-[(2-methoxy-2-oxidanylidene-ethyl)sulfanylmethyl]-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-[(2-methoxy-2-oxidanylidene-ethyl)sulfanylmethyl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[(2-methoxy-2-oxo-ethyl)sulfanylmethyl]thiazole-2-carboxylic acid CAS Name: 4-[[(2-methoxy-2-oxoethyl)thio]methyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[(2-methoxy-2-oxoethyl)sulfanylmethyl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[[(2-keto-2-methoxy-ethyl)thio]methyl]thiazole-2-carboxylic acid Formula: C8H9NO4S2 MolecularWeight: 247.29136

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSCC1=CSC(=N1)C(=O)O

Isomeric SMILES

COC(=O)CSCC1=CSC(=N1)C(=O)O

InChI

InChI=1S/C8H9NO4S2/c1-13-6(10)4-14-2-5-3-15-7(9-5)8(11)12/h3H,2,4H2,1H3,(H,11,12)