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

Systemtic Name: 3,5-bis(methylsulfonyl)-1,2-thiazole-4-carboxylic acid Openeye Name: 3,5-bis(methylsulfonyl)isothiazole-4-carboxylic acid CAS Name: 3,5-bis(methylsulfonyl)-4-isothiazolecarboxylic acid IUPAC Name: 3,5-bis(methylsulfonyl)-1,2-thiazole-4-carboxylic acid Traditional Name: 3,5-dimesylisothiazole-4-carboxylic acid Formula: C6H7NO6S3 MolecularWeight: 285.31788

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C(=NS1)S(=O)(=O)C)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=C(C(=NS1)S(=O)(=O)C)C(=O)O

InChI

InChI=1S/C6H7NO6S3/c1-15(10,11)4-3(5(8)9)6(14-7-4)16(2,12)13/h1-2H3,(H,8,9)