4-[[1,1-bis(oxidanylidene)thian-4-yl]sulfamoyl]-5-bromanyl-thiophene-2-carboxylic acid

Systemtic Name: 4-[[1,1-bis(oxidanylidene)thian-4-yl]sulfamoyl]-5-bromanyl-thiophene-2-carboxylic acid Openeye Name: 5-bromo-4-[(1,1-dioxothian-4-yl)sulfamoyl]thiophene-2-carboxylic acid CAS Name: 5-bromo-4-[(1,1-dioxo-4-thianyl)sulfamoyl]-2-thiophenecarboxylic acid IUPAC Name: 5-bromo-4-[(1,1-dioxothian-4-yl)sulfamoyl]thiophene-2-carboxylic acid Traditional Name: 5-bromo-4-[(1,1-diketothian-4-yl)sulfamoyl]-2-thenoic acid Formula: C10H12BrNO6S3 MolecularWeight: 418.30438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCC1NS(=O)(=O)C2=C(SC(=C2)C(=O)O)Br

Isomeric SMILES

C1CS(=O)(=O)CCC1NS(=O)(=O)C2=C(SC(=C2)C(=O)O)Br

InChI

InChI=1S/C10H12BrNO6S3/c11-9-8(5-7(19-9)10(13)14)21(17,18)12-6-1-3-20(15,16)4-2-6/h5-6,12H,1-4H2,(H,13,14)