ethyl 5-phenyl-1-[6-[[4-(trifluoromethyloxy)phenyl]amino]pyrimidin-4-yl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-phenyl-1-[6-[[4-(trifluoromethyloxy)phenyl]amino]pyrimidin-4-yl]pyrazole-4-carboxylate Openeye Name: ethyl 5-phenyl-1-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]pyrazole-4-carboxylate CAS Name: 5-phenyl-1-[6-[4-(trifluoromethoxy)anilino]-4-pyrimidinyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-phenyl-1-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]pyrazole-4-carboxylate Traditional Name: 5-phenyl-1-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]pyrazole-4-carboxylic acid ethyl ester Formula: C23H18F3N5O3 MolecularWeight: 469.41593

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=NC=N2)NC3=CC=C(C=C3)OC(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=NC=N2)NC3=CC=C(C=C3)OC(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C23H18F3N5O3/c1-2-33-22(32)18-13-29-31(21(18)15-6-4-3-5-7-15)20-12-19(27-14-28-20)30-16-8-10-17(11-9-16)34-23(24,25)26/h3-14H,2H2,1H3,(H,27,28,30)