[5-cyclopropyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [5-cyclopropyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [5-cyclopropyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [5-cyclopropyl-1-[3-(trifluoromethyl)phenyl]-4-pyrazolyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [5-cyclopropyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [5-cyclopropyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C22H21F3N6O MolecularWeight: 442.43695

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(C=NN2C3=CC=CC(=C3)C(F)(F)F)C(=O)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

C1CC1C2=C(C=NN2C3=CC=CC(=C3)C(F)(F)F)C(=O)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C22H21F3N6O/c23-22(24,25)16-3-1-4-17(13-16)31-19(15-5-6-15)18(14-28-31)20(32)29-9-11-30(12-10-29)21-26-7-2-8-27-21/h1-4,7-8,13-15H,5-6,9-12H2