(2R,5S)-4-[4-cyano-3-(trifluoromethyl)phenyl]-2,5-dimethyl-N-pyrimidin-2-yl-piperazine-1-carboxamide

Systemtic Name: (2R,5S)-4-[4-cyano-3-(trifluoromethyl)phenyl]-2,5-dimethyl-N-pyrimidin-2-yl-piperazine-1-carboxamide Openeye Name: (2R,5S)-4-[4-cyano-3-(trifluoromethyl)phenyl]-2,5-dimethyl-N-pyrimidin-2-yl-piperazine-1-carboxamide CAS Name: (2R,5S)-4-[4-cyano-3-(trifluoromethyl)phenyl]-2,5-dimethyl-N-(2-pyrimidinyl)-1-piperazinecarboxamide IUPAC Name: (2R,5S)-4-[4-cyano-3-(trifluoromethyl)phenyl]-2,5-dimethyl-N-pyrimidin-2-ylpiperazine-1-carboxamide Traditional Name: (2R,5S)-4-[4-cyano-3-(trifluoromethyl)phenyl]-2,5-dimethyl-N-(2-pyrimidyl)piperazine-1-carboxamide Formula: C19H19F3N6O MolecularWeight: 404.38897

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(CN1C(=O)NC2=NC=CC=N2)C)C3=CC(=C(C=C3)C#N)C(F)(F)F

Isomeric SMILES

C[C@@H]1CN([C@H](CN1C(=O)NC2=NC=CC=N2)C)C3=CC(=C(C=C3)C#N)C(F)(F)F

InChI

InChI=1S/C19H19F3N6O/c1-12-11-28(18(29)26-17-24-6-3-7-25-17)13(2)10-27(12)15-5-4-14(9-23)16(8-15)19(20,21)22/h3-8,12-13H,10-11H2,1-2H3,(H,24,25,26,29)/t12-,13+/m0/s1