ethyl 4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: ethyl 4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: ethyl 4-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 4-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-7-(trifluoromethyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 4-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]-7-(trifluoromethyl)quinoline-3-carboxylic acid ethyl ester Formula: C24H21F3N4O3 MolecularWeight: 470.44375

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=C(C=CC2=C1NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CN=C2C=C(C=CC2=C1NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)C(F)(F)F

InChI

InChI=1S/C24H21F3N4O3/c1-4-34-23(33)18-13-28-19-12-15(24(25,26)27)10-11-17(19)21(18)29-20-14(2)30(3)31(22(20)32)16-8-6-5-7-9-16/h5-13H,4H2,1-3H3,(H,28,29)