3,4-bis(methylsulfonyl)-5H-1,2-thiazole-4-carboxylic acid

Systemtic Name: 3,4-bis(methylsulfonyl)-5H-1,2-thiazole-4-carboxylic acid Openeye Name: 3,4-bis(methylsulfonyl)-5H-isothiazole-4-carboxylic acid CAS Name: 3,4-bis(methylsulfonyl)-5H-isothiazole-4-carboxylic acid IUPAC Name: 3,4-bis(methylsulfonyl)-5H-1,2-thiazole-4-carboxylic acid Traditional Name: 3,4-dimesyl-2-isothiazoline-4-carboxylic acid Formula: C6H9NO6S3 MolecularWeight: 287.33376

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NSCC1(C(=O)O)S(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)C1=NSCC1(C(=O)O)S(=O)(=O)C

InChI

InChI=1S/C6H9NO6S3/c1-15(10,11)4-6(5(8)9,3-14-7-4)16(2,12)13/h3H2,1-2H3,(H,8,9)