[2-oxidanylidene-2-(1-phenylethylamino)ethyl] 1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-(1-phenylethylamino)ethyl] 1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxylate Openeye Name: [2-oxo-2-(1-phenylethylamino)ethyl] 1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxylate CAS Name: 1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxylic acid [2-oxo-2-(1-phenylethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(1-phenylethylamino)ethyl] 1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxylic acid [2-keto-2-(1-phenylethylamino)ethyl] ester Formula: C20H19FN4O3 MolecularWeight: 382.388263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1C2=CC=C(C=C2)F)C(=O)OCC(=O)NC(C)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=NN1C2=CC=C(C=C2)F)C(=O)OCC(=O)NC(C)C3=CC=CC=C3

InChI

InChI=1S/C20H19FN4O3/c1-13(15-6-4-3-5-7-15)22-18(26)12-28-20(27)19-23-14(2)25(24-19)17-10-8-16(21)9-11-17/h3-11,13H,12H2,1-2H3,(H,22,26)