2-[3,5-dimethyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazol-4-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[3,5-dimethyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazol-4-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[3,5-dimethyl-1-[5-(trifluoromethyl)-2-pyridyl]pyrazol-4-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[3,5-dimethyl-1-[5-(trifluoromethyl)-2-pyridinyl]-4-pyrazolyl]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[3,5-dimethyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazol-4-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[3,5-dimethyl-1-[5-(trifluoromethyl)-2-pyridyl]pyrazol-4-yl]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C21H22F3N7O MolecularWeight: 445.44089

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=NC=C(C=C2)C(F)(F)F)C)CC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC1=C(C(=NN1C2=NC=C(C=C2)C(F)(F)F)C)CC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C21H22F3N7O/c1-14-17(15(2)31(28-14)18-5-4-16(13-27-18)21(22,23)24)12-19(32)29-8-10-30(11-9-29)20-25-6-3-7-26-20/h3-7,13H,8-12H2,1-2H3