3,4-dimethyl-5-(thiophen-2-ylmethylsulfamoyl)benzoic acid

Systemtic Name: 3,4-dimethyl-5-(thiophen-2-ylmethylsulfamoyl)benzoic acid Openeye Name: 3,4-dimethyl-5-(2-thienylmethylsulfamoyl)benzoic acid CAS Name: 3,4-dimethyl-5-(thiophen-2-ylmethylsulfamoyl)benzoic acid IUPAC Name: 3,4-dimethyl-5-(thiophen-2-ylmethylsulfamoyl)benzoic acid Traditional Name: 3,4-dimethyl-5-(2-thenylsulfamoyl)benzoic acid Formula: C14H15NO4S2 MolecularWeight: 325.4032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NCC2=CC=CS2)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NCC2=CC=CS2)C

InChI

InChI=1S/C14H15NO4S2/c1-9-6-11(14(16)17)7-13(10(9)2)21(18,19)15-8-12-4-3-5-20-12/h3-7,15H,8H2,1-2H3,(H,16,17)