(2R)-2-phenyl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)-N-[3-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: (2R)-2-phenyl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)-N-[3-(trifluoromethyl)phenyl]ethanamide Openeye Name: (2R)-2-phenyl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide CAS Name: (2R)-2-phenyl-2-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]-N-[3-(trifluoromethyl)phenyl]acetamide IUPAC Name: (2R)-2-phenyl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide Traditional Name: (2R)-2-phenyl-2-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]-N-[3-(trifluoromethyl)phenyl]acetamide Formula: C23H23F3N5O+ MolecularWeight: 442.45683

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F)C4=NC=CC=N4

Isomeric SMILES

C1CN(CC[NH+]1[C@H](C2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F)C4=NC=CC=N4

InChI

InChI=1S/C23H22F3N5O/c24-23(25,26)18-8-4-9-19(16-18)29-21(32)20(17-6-2-1-3-7-17)30-12-14-31(15-13-30)22-27-10-5-11-28-22/h1-11,16,20H,12-15H2,(H,29,32)/p+1/t20-/m1/s1