[2-(aminocarbonylamino)-2-oxidanylidene-ethyl] 5-methyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxylate

Systemtic Name: [2-(aminocarbonylamino)-2-oxidanylidene-ethyl] 5-methyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxylate Openeye Name: (2-oxo-2-ureido-ethyl) 5-methyl-1-[5-(trifluoromethyl)-2-pyridyl]pyrazole-4-carboxylate CAS Name: 5-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]-4-pyrazolecarboxylic acid [2-(carbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(carbamoylamino)-2-oxoethyl] 5-methyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxylate Traditional Name: 5-methyl-1-[5-(trifluoromethyl)-2-pyridyl]pyrazole-4-carboxylic acid (2-keto-2-ureido-ethyl) ester Formula: C14H12F3N5O4 MolecularWeight: 371.27139

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=NC=C(C=C2)C(F)(F)F)C(=O)OCC(=O)NC(=O)N

Isomeric SMILES

CC1=C(C=NN1C2=NC=C(C=C2)C(F)(F)F)C(=O)OCC(=O)NC(=O)N

InChI

InChI=1S/C14H12F3N5O4/c1-7-9(12(24)26-6-11(23)21-13(18)25)5-20-22(7)10-3-2-8(4-19-10)14(15,16)17/h2-5H,6H2,1H3,(H3,18,21,23,25)