4-[2-[4-(methylsulfonylamino)phenyl]-5-(trifluoromethyl)pyrazol-3-yl]benzoic acid

Systemtic Name: 4-[2-[4-(methylsulfonylamino)phenyl]-5-(trifluoromethyl)pyrazol-3-yl]benzoic acid Openeye Name: 4-[2-[4-(methanesulfonamido)phenyl]-5-(trifluoromethyl)pyrazol-3-yl]benzoic acid CAS Name: 4-[2-[4-(methanesulfonamido)phenyl]-5-(trifluoromethyl)-3-pyrazolyl]benzoic acid IUPAC Name: 4-[2-[4-(methanesulfonamido)phenyl]-5-(trifluoromethyl)pyrazol-3-yl]benzoic acid Traditional Name: 4-[2-[4-(methanesulfonamido)phenyl]-5-(trifluoromethyl)pyrazol-3-yl]benzoic acid Formula: C18H14F3N3O4S MolecularWeight: 425.38167

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H14F3N3O4S/c1-29(27,28)23-13-6-8-14(9-7-13)24-15(10-16(22-24)18(19,20)21)11-2-4-12(5-3-11)17(25)26/h2-10,23H,1H3,(H,25,26)