[2-oxidanylidene-2-[(4-sulfamoylphenyl)methylamino]ethyl] 2-[(2-fluorophenyl)amino]pyridine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(4-sulfamoylphenyl)methylamino]ethyl] 2-[(2-fluorophenyl)amino]pyridine-3-carboxylate Openeye Name: [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] 2-(2-fluoroanilino)pyridine-3-carboxylate CAS Name: 2-(2-fluoroanilino)-3-pyridinecarboxylic acid [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] ester IUPAC Name: [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] 2-(2-fluoroanilino)pyridine-3-carboxylate Traditional Name: 2-(2-fluoroanilino)nicotinic acid [2-keto-2-[(4-sulfamoylbenzyl)amino]ethyl] ester Formula: C21H19FN4O5S MolecularWeight: 458.462763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC2=C(C=CC=N2)C(=O)OCC(=O)NCC3=CC=C(C=C3)S(=O)(=O)N)F

Isomeric SMILES

C1=CC=C(C(=C1)NC2=C(C=CC=N2)C(=O)OCC(=O)NCC3=CC=C(C=C3)S(=O)(=O)N)F

InChI

InChI=1S/C21H19FN4O5S/c22-17-5-1-2-6-18(17)26-20-16(4-3-11-24-20)21(28)31-13-19(27)25-12-14-7-9-15(10-8-14)32(23,29)30/h1-11H,12-13H2,(H,24,26)(H,25,27)(H2,23,29,30)