5-bromanyl-4-[2-cyanoethyl(propan-2-yl)sulfamoyl]thiophene-2-carboxylic acid

Systemtic Name: 5-bromanyl-4-[2-cyanoethyl(propan-2-yl)sulfamoyl]thiophene-2-carboxylic acid Openeye Name: 5-bromo-4-[2-cyanoethyl(isopropyl)sulfamoyl]thiophene-2-carboxylic acid CAS Name: 5-bromo-4-[2-cyanoethyl(propan-2-yl)sulfamoyl]-2-thiophenecarboxylic acid IUPAC Name: 5-bromo-4-[2-cyanoethyl(propan-2-yl)sulfamoyl]thiophene-2-carboxylic acid Traditional Name: 5-bromo-4-[2-cyanoethyl(isopropyl)sulfamoyl]-2-thenoic acid Formula: C11H13BrN2O4S2 MolecularWeight: 381.26592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCC#N)S(=O)(=O)C1=C(SC(=C1)C(=O)O)Br

Isomeric SMILES

CC(C)N(CCC#N)S(=O)(=O)C1=C(SC(=C1)C(=O)O)Br

InChI

InChI=1S/C11H13BrN2O4S2/c1-7(2)14(5-3-4-13)20(17,18)9-6-8(11(15)16)19-10(9)12/h6-7H,3,5H2,1-2H3,(H,15,16)