5-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethylsulfamoyl]thiophene-3-carboxylic acid

Systemtic Name: 5-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethylsulfamoyl]thiophene-3-carboxylic acid Openeye Name: 5-[2-(2-bromo-4,5-dimethoxy-phenyl)ethylsulfamoyl]thiophene-3-carboxylic acid CAS Name: 5-[2-(2-bromo-4,5-dimethoxyphenyl)ethylsulfamoyl]-3-thiophenecarboxylic acid IUPAC Name: 5-[2-(2-bromo-4,5-dimethoxyphenyl)ethylsulfamoyl]thiophene-3-carboxylic acid Traditional Name: 5-[2-(2-bromo-4,5-dimethoxy-phenyl)ethylsulfamoyl]-3-thenoic acid Formula: C15H16BrNO6S2 MolecularWeight: 450.32464

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNS(=O)(=O)C2=CC(=CS2)C(=O)O)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNS(=O)(=O)C2=CC(=CS2)C(=O)O)Br)OC

InChI

InChI=1S/C15H16BrNO6S2/c1-22-12-5-9(11(16)7-13(12)23-2)3-4-17-25(20,21)14-6-10(8-24-14)15(18)19/h5-8,17H,3-4H2,1-2H3,(H,18,19)