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

Systemtic Name: 4-[bis(2-cyanoethyl)sulfamoyl]-5-bromanyl-thiophene-2-carboxylic acid Openeye Name: 4-[bis(2-cyanoethyl)sulfamoyl]-5-bromo-thiophene-2-carboxylic acid CAS Name: 4-[bis(2-cyanoethyl)sulfamoyl]-5-bromo-2-thiophenecarboxylic acid IUPAC Name: 4-[bis(2-cyanoethyl)sulfamoyl]-5-bromothiophene-2-carboxylic acid Traditional Name: 4-[bis(2-cyanoethyl)sulfamoyl]-5-bromo-2-thenoic acid Formula: C11H10BrN3O4S2 MolecularWeight: 392.2488

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1S(=O)(=O)N(CCC#N)CCC#N)Br)C(=O)O

Isomeric SMILES

C1=C(SC(=C1S(=O)(=O)N(CCC#N)CCC#N)Br)C(=O)O

InChI

InChI=1S/C11H10BrN3O4S2/c12-10-9(7-8(20-10)11(16)17)21(18,19)15(5-1-3-13)6-2-4-14/h7H,1-2,5-6H2,(H,16,17)