[3-(trifluoromethyl)phenyl]methyl 1-ethyl-5-[(4-methylpyridin-3-yl)amino]-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: [3-(trifluoromethyl)phenyl]methyl 1-ethyl-5-[(4-methylpyridin-3-yl)amino]-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: [3-(trifluoromethyl)phenyl]methyl 1-ethyl-5-[(4-methyl-3-pyridyl)amino]-6-oxo-pyridazine-3-carboxylate CAS Name: 1-ethyl-5-[(4-methyl-3-pyridinyl)amino]-6-oxo-3-pyridazinecarboxylic acid [3-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [3-(trifluoromethyl)phenyl]methyl 1-ethyl-5-[(4-methylpyridin-3-yl)amino]-6-oxopyridazine-3-carboxylate Traditional Name: 1-ethyl-6-keto-5-[(4-methyl-3-pyridyl)amino]pyridazine-3-carboxylic acid [3-(trifluoromethyl)benzyl] ester Formula: C21H19F3N4O3 MolecularWeight: 432.39577

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC(=N1)C(=O)OCC2=CC(=CC=C2)C(F)(F)F)NC3=C(C=CN=C3)C

Isomeric SMILES

CCN1C(=O)C(=CC(=N1)C(=O)OCC2=CC(=CC=C2)C(F)(F)F)NC3=C(C=CN=C3)C

InChI

InChI=1S/C21H19F3N4O3/c1-3-28-19(29)16(26-18-11-25-8-7-13(18)2)10-17(27-28)20(30)31-12-14-5-4-6-15(9-14)21(22,23)24/h4-11,26H,3,12H2,1-2H3