[4-(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)piperazin-1-yl]-[3-(trifluoromethyl)phenyl]methanone

Systemtic Name: [4-(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)piperazin-1-yl]-[3-(trifluoromethyl)phenyl]methanone Openeye Name: [4-(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)piperazin-1-yl]-[3-(trifluoromethyl)phenyl]methanone CAS Name: [4-[2-methyl-6-(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinyl]-[3-(trifluoromethyl)phenyl]methanone IUPAC Name: [4-(2-methyl-6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]-[3-(trifluoromethyl)phenyl]methanone Traditional Name: [4-(2-methyl-6-pyrrolidino-pyrimidin-4-yl)piperazino]-[3-(trifluoromethyl)phenyl]methanone Formula: C21H24F3N5O MolecularWeight: 419.44337

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)C(F)(F)F)N4CCCC4

Isomeric SMILES

CC1=NC(=CC(=N1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)C(F)(F)F)N4CCCC4

InChI

InChI=1S/C21H24F3N5O/c1-15-25-18(27-7-2-3-8-27)14-19(26-15)28-9-11-29(12-10-28)20(30)16-5-4-6-17(13-16)21(22,23)24/h4-6,13-14H,2-3,7-12H2,1H3