[2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[(2-fluorophenyl)amino]pyridine-3-carboxylate

Systemtic Name: [2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[(2-fluorophenyl)amino]pyridine-3-carboxylate Openeye Name: [2-(isobutylcarbamoylamino)-2-oxo-ethyl] 2-(2-fluoroanilino)pyridine-3-carboxylate CAS Name: 2-(2-fluoroanilino)-3-pyridinecarboxylic acid [2-[[(2-methylpropylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(2-methylpropylcarbamoylamino)-2-oxoethyl] 2-(2-fluoroanilino)pyridine-3-carboxylate Traditional Name: 2-(2-fluoroanilino)nicotinic acid [2-(isobutylcarbamoylamino)-2-keto-ethyl] ester Formula: C19H21FN4O4 MolecularWeight: 388.392843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(=O)COC(=O)C1=C(N=CC=C1)NC2=CC=CC=C2F

Isomeric SMILES

CC(C)CNC(=O)NC(=O)COC(=O)C1=C(N=CC=C1)NC2=CC=CC=C2F

InChI

InChI=1S/C19H21FN4O4/c1-12(2)10-22-19(27)24-16(25)11-28-18(26)13-6-5-9-21-17(13)23-15-8-4-3-7-14(15)20/h3-9,12H,10-11H2,1-2H3,(H,21,23)(H2,22,24,25,27)