2-bromanyl-5-[methyl(thiophen-2-ylmethyl)sulfamoyl]benzoic acid

Systemtic Name: 2-bromanyl-5-[methyl(thiophen-2-ylmethyl)sulfamoyl]benzoic acid Openeye Name: 2-bromo-5-[methyl(2-thienylmethyl)sulfamoyl]benzoic acid CAS Name: 2-bromo-5-[methyl(thiophen-2-ylmethyl)sulfamoyl]benzoic acid IUPAC Name: 2-bromo-5-[methyl(thiophen-2-ylmethyl)sulfamoyl]benzoic acid Traditional Name: 2-bromo-5-[methyl(2-thenyl)sulfamoyl]benzoic acid Formula: C13H12BrNO4S2 MolecularWeight: 390.27268

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CS1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)O

Isomeric SMILES

CN(CC1=CC=CS1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C13H12BrNO4S2/c1-15(8-9-3-2-6-20-9)21(18,19)10-4-5-12(14)11(7-10)13(16)17/h2-7H,8H2,1H3,(H,16,17)