1-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]-2-[4-(trifluoromethyl)phenoxy]ethanone

Systemtic Name: 1-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]-2-[4-(trifluoromethyl)phenoxy]ethanone Openeye Name: 1-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]-2-[4-(trifluoromethyl)phenoxy]ethanone CAS Name: 1-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]-2-[4-(trifluoromethyl)phenoxy]ethanone IUPAC Name: 1-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]-2-[4-(trifluoromethyl)phenoxy]ethanone Traditional Name: 1-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazino]-2-[4-(trifluoromethyl)phenoxy]ethanone Formula: C21H25F3N4O2 MolecularWeight: 422.44401

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)COC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)COC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C21H25F3N4O2/c1-14(2)20-25-15(3)12-18(26-20)27-8-10-28(11-9-27)19(29)13-30-17-6-4-16(5-7-17)21(22,23)24/h4-7,12,14H,8-11,13H2,1-3H3