2-[5-[(4-pyrrolidin-1-ylsulfonylphenyl)carbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]benzoic acid

Systemtic Name: 2-[5-[(4-pyrrolidin-1-ylsulfonylphenyl)carbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]benzoic acid Openeye Name: 2-[5-[(4-pyrrolidin-1-ylsulfonylphenyl)carbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]benzoic acid CAS Name: 2-[5-[oxo-[4-(1-pyrrolidinylsulfonyl)anilino]methyl]-3-(trifluoromethyl)-1-pyrazolyl]benzoic acid IUPAC Name: 2-[5-[(4-pyrrolidin-1-ylsulfonylphenyl)carbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]benzoic acid Traditional Name: 2-[5-[(4-pyrrolidinosulfonylphenyl)carbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]benzoic acid Formula: C22H19F3N4O5S MolecularWeight: 508.47027

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=NN3C4=CC=CC=C4C(=O)O)C(F)(F)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=NN3C4=CC=CC=C4C(=O)O)C(F)(F)F

InChI

InChI=1S/C22H19F3N4O5S/c23-22(24,25)19-13-18(29(27-19)17-6-2-1-5-16(17)21(31)32)20(30)26-14-7-9-15(10-8-14)35(33,34)28-11-3-4-12-28/h1-2,5-10,13H,3-4,11-12H2,(H,26,30)(H,31,32)