5-bromanyl-4-[[2-(dimethylamino)-2-oxidanylidene-ethyl]-ethyl-sulfamoyl]thiophene-2-carboxylic acid

Systemtic Name: 5-bromanyl-4-[[2-(dimethylamino)-2-oxidanylidene-ethyl]-ethyl-sulfamoyl]thiophene-2-carboxylic acid Openeye Name: 5-bromo-4-[[2-(dimethylamino)-2-oxo-ethyl]-ethyl-sulfamoyl]thiophene-2-carboxylic acid CAS Name: 5-bromo-4-[[2-(dimethylamino)-2-oxoethyl]-ethylsulfamoyl]-2-thiophenecarboxylic acid IUPAC Name: 5-bromo-4-[[2-(dimethylamino)-2-oxoethyl]-ethylsulfamoyl]thiophene-2-carboxylic acid Traditional Name: 5-bromo-4-[[2-(dimethylamino)-2-keto-ethyl]-ethyl-sulfamoyl]-2-thenoic acid Formula: C11H15BrN2O5S2 MolecularWeight: 399.2812

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)N(C)C)S(=O)(=O)C1=C(SC(=C1)C(=O)O)Br

Isomeric SMILES

CCN(CC(=O)N(C)C)S(=O)(=O)C1=C(SC(=C1)C(=O)O)Br

InChI

InChI=1S/C11H15BrN2O5S2/c1-4-14(6-9(15)13(2)3)21(18,19)8-5-7(11(16)17)20-10(8)12/h5H,4,6H2,1-3H3,(H,16,17)