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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21FN4O4/c1-19(2,3)24-18(27)23-15(25)11-28-17(26)12-7-6-10-21-16(12)22-14-9-5-4-8-13(14)20/h4-10H,11H2,1-3H3,(H,21,22)(H2,23,24,25,27)