4-[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-sulfamoyl]-5-bromanyl-thiophene-2-carboxylic acid

Systemtic Name: 4-[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-sulfamoyl]-5-bromanyl-thiophene-2-carboxylic acid Openeye Name: 5-bromo-4-[(1,1-dioxothiolan-3-yl)-methyl-sulfamoyl]thiophene-2-carboxylic acid CAS Name: 5-bromo-4-[(1,1-dioxo-3-thiolanyl)-methylsulfamoyl]-2-thiophenecarboxylic acid IUPAC Name: 5-bromo-4-[(1,1-dioxothiolan-3-yl)-methylsulfamoyl]thiophene-2-carboxylic acid Traditional Name: 5-bromo-4-[(1,1-diketothiolan-3-yl)-methyl-sulfamoyl]-2-thenoic acid Formula: C10H12BrNO6S3 MolecularWeight: 418.30438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)S(=O)(=O)C2=C(SC(=C2)C(=O)O)Br

Isomeric SMILES

CN(C1CCS(=O)(=O)C1)S(=O)(=O)C2=C(SC(=C2)C(=O)O)Br

InChI

InChI=1S/C10H12BrNO6S3/c1-12(6-2-3-20(15,16)5-6)21(17,18)8-4-7(10(13)14)19-9(8)11/h4,6H,2-3,5H2,1H3,(H,13,14)