3,4-dimethyl-5-[[[5-(trifluoromethyl)pyridin-2-yl]amino]sulfamoyl]benzoic acid

Systemtic Name: 3,4-dimethyl-5-[[[5-(trifluoromethyl)pyridin-2-yl]amino]sulfamoyl]benzoic acid Openeye Name: 3,4-dimethyl-5-[[[5-(trifluoromethyl)-2-pyridyl]amino]sulfamoyl]benzoic acid CAS Name: 3,4-dimethyl-5-[[[5-(trifluoromethyl)-2-pyridinyl]amino]sulfamoyl]benzoic acid IUPAC Name: 3,4-dimethyl-5-[[[5-(trifluoromethyl)pyridin-2-yl]amino]sulfamoyl]benzoic acid Traditional Name: 3,4-dimethyl-5-[[[5-(trifluoromethyl)-2-pyridyl]amino]sulfamoyl]benzoic acid Formula: C15H14F3N3O4S MolecularWeight: 389.34957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NNC2=NC=C(C=C2)C(F)(F)F)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NNC2=NC=C(C=C2)C(F)(F)F)C

InChI

InChI=1S/C15H14F3N3O4S/c1-8-5-10(14(22)23)6-12(9(8)2)26(24,25)21-20-13-4-3-11(7-19-13)15(16,17)18/h3-7,21H,1-2H3,(H,19,20)(H,22,23)