1-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]-2-[3-(trifluoromethyl)phenoxy]ethanone

Systemtic Name: 1-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]-2-[3-(trifluoromethyl)phenoxy]ethanone Openeye Name: 1-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]-2-[3-(trifluoromethyl)phenoxy]ethanone CAS Name: 1-[4-[6-(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinyl]-2-[3-(trifluoromethyl)phenoxy]ethanone IUPAC Name: 1-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]-2-[3-(trifluoromethyl)phenoxy]ethanone Traditional Name: 1-[4-(6-pyrrolidinopyrimidin-4-yl)piperazino]-2-[3-(trifluoromethyl)phenoxy]ethanone Formula: C21H24F3N5O2 MolecularWeight: 435.44277

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)COC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CCN(C1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)COC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C21H24F3N5O2/c22-21(23,24)16-4-3-5-17(12-16)31-14-20(30)29-10-8-28(9-11-29)19-13-18(25-15-26-19)27-6-1-2-7-27/h3-5,12-13,15H,1-2,6-11,14H2