ethyl 2-(4-methylpyrazol-1-yl)-4-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]amino]pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-(4-methylpyrazol-1-yl)-4-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]amino]pyrimidine-5-carboxylate Openeye Name: ethyl 2-(4-methylpyrazol-1-yl)-4-[2-(1-piperidyl)-5-(trifluoromethyl)anilino]pyrimidine-5-carboxylate CAS Name: 2-(4-methyl-1-pyrazolyl)-4-[2-(1-piperidinyl)-5-(trifluoromethyl)anilino]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-methylpyrazol-1-yl)-4-[2-piperidin-1-yl-5-(trifluoromethyl)anilino]pyrimidine-5-carboxylate Traditional Name: 2-(4-methylpyrazol-1-yl)-4-[2-piperidino-5-(trifluoromethyl)anilino]pyrimidine-5-carboxylic acid ethyl ester Formula: C23H25F3N6O2 MolecularWeight: 474.47881

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NC2=C(C=CC(=C2)C(F)(F)F)N3CCCCC3)N4C=C(C=N4)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NC2=C(C=CC(=C2)C(F)(F)F)N3CCCCC3)N4C=C(C=N4)C

InChI

InChI=1S/C23H25F3N6O2/c1-3-34-21(33)17-13-27-22(32-14-15(2)12-28-32)30-20(17)29-18-11-16(23(24,25)26)7-8-19(18)31-9-5-4-6-10-31/h7-8,11-14H,3-6,9-10H2,1-2H3,(H,27,29,30)