3-[(4,6-dimethyl-1,3-benzothiazol-2-yl)sulfamoyl]benzoic acid

Systemtic Name: 3-[(4,6-dimethyl-1,3-benzothiazol-2-yl)sulfamoyl]benzoic acid Openeye Name: 3-[(4,6-dimethyl-1,3-benzothiazol-2-yl)sulfamoyl]benzoic acid CAS Name: 3-[(4,6-dimethyl-1,3-benzothiazol-2-yl)sulfamoyl]benzoic acid IUPAC Name: 3-[(4,6-dimethyl-1,3-benzothiazol-2-yl)sulfamoyl]benzoic acid Traditional Name: 3-[(4,6-dimethyl-1,3-benzothiazol-2-yl)sulfamoyl]benzoic acid Formula: C16H14N2O4S2 MolecularWeight: 362.42336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)O)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)O)C

InChI

InChI=1S/C16H14N2O4S2/c1-9-6-10(2)14-13(7-9)23-16(17-14)18-24(21,22)12-5-3-4-11(8-12)15(19)20/h3-8H,1-2H3,(H,17,18)(H,19,20)