5-[[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]sulfonyl]-3-methyl-thiophene-2-carboxylic acid

Systemtic Name: 5-[[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]sulfonyl]-3-methyl-thiophene-2-carboxylic acid Openeye Name: 5-[(1,1-dioxo-1,4-thiazinan-4-yl)sulfonyl]-3-methyl-thiophene-2-carboxylic acid CAS Name: 5-[(1,1-dioxo-1,4-thiazinan-4-yl)sulfonyl]-3-methyl-2-thiophenecarboxylic acid IUPAC Name: 5-[(1,1-dioxo-1,4-thiazinan-4-yl)sulfonyl]-3-methylthiophene-2-carboxylic acid Traditional Name: 5-[(1,1-diketo-1,4-thiazinan-4-yl)sulfonyl]-3-methyl-2-thenoic acid Formula: C10H13NO6S3 MolecularWeight: 339.40832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)S(=O)(=O)N2CCS(=O)(=O)CC2)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1)S(=O)(=O)N2CCS(=O)(=O)CC2)C(=O)O

InChI

InChI=1S/C10H13NO6S3/c1-7-6-8(18-9(7)10(12)13)20(16,17)11-2-4-19(14,15)5-3-11/h6H,2-5H2,1H3,(H,12,13)