2-[5-methyl-2-(methylsulfamoyl)phenyl]sulfanylbenzoic acid

Systemtic Name: 2-[5-methyl-2-(methylsulfamoyl)phenyl]sulfanylbenzoic acid Openeye Name: 2-[5-methyl-2-(methylsulfamoyl)phenyl]sulfanylbenzoic acid CAS Name: 2-[[5-methyl-2-(methylsulfamoyl)phenyl]thio]benzoic acid IUPAC Name: 2-[5-methyl-2-(methylsulfamoyl)phenyl]sulfanylbenzoic acid Traditional Name: 2-[[5-methyl-2-(methylsulfamoyl)phenyl]thio]benzoic acid Formula: C15H15NO4S2 MolecularWeight: 337.4139

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)NC)SC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)NC)SC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C15H15NO4S2/c1-10-7-8-14(22(19,20)16-2)13(9-10)21-12-6-4-3-5-11(12)15(17)18/h3-9,16H,1-2H3,(H,17,18)