5-[[4-[2-[(4-fluorophenyl)carbonylamino]ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylic acid

Systemtic Name: 5-[[4-[2-[(4-fluorophenyl)carbonylamino]ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylic acid Openeye Name: 5-[[4-[2-[(4-fluorobenzoyl)amino]ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylic acid CAS Name: 5-[[[4-[2-[[(4-fluorophenyl)-oxomethyl]amino]ethyl]phenyl]sulfonylamino]-oxomethyl]-2-pyridinecarboxylic acid IUPAC Name: 5-[[4-[2-[(4-fluorobenzoyl)amino]ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylic acid Traditional Name: 5-[[4-[2-[(4-fluorobenzoyl)amino]ethyl]phenyl]sulfonylcarbamoyl]picolinic acid Formula: C22H18FN3O6S MolecularWeight: 471.458223

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC(=O)C2=CC=C(C=C2)F)S(=O)(=O)NC(=O)C3=CN=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CCNC(=O)C2=CC=C(C=C2)F)S(=O)(=O)NC(=O)C3=CN=C(C=C3)C(=O)O

InChI

InChI=1S/C22H18FN3O6S/c23-17-6-3-15(4-7-17)20(27)24-12-11-14-1-8-18(9-2-14)33(31,32)26-21(28)16-5-10-19(22(29)30)25-13-16/h1-10,13H,11-12H2,(H,24,27)(H,26,28)(H,29,30)