ethyl 1-(4-propan-2-ylphenyl)-5-[[3-(trifluoromethyl)phenyl]carbonylamino]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(4-propan-2-ylphenyl)-5-[[3-(trifluoromethyl)phenyl]carbonylamino]pyrazole-4-carboxylate Openeye Name: ethyl 1-(4-isopropylphenyl)-5-[[3-(trifluoromethyl)benzoyl]amino]pyrazole-4-carboxylate CAS Name: 5-[[oxo-[3-(trifluoromethyl)phenyl]methyl]amino]-1-(4-propan-2-ylphenyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-propan-2-ylphenyl)-5-[[3-(trifluoromethyl)benzoyl]amino]pyrazole-4-carboxylate Traditional Name: 1-p-cumenyl-5-[[3-(trifluoromethyl)benzoyl]amino]pyrazole-4-carboxylic acid ethyl ester Formula: C23H22F3N3O3 MolecularWeight: 445.43429

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(C)C)NC(=O)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(C)C)NC(=O)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C23H22F3N3O3/c1-4-32-22(31)19-13-27-29(18-10-8-15(9-11-18)14(2)3)20(19)28-21(30)16-6-5-7-17(12-16)23(24,25)26/h5-14H,4H2,1-3H3,(H,28,30)