N-[4-(dimethylamino)-5-phenyl-pyrimidin-2-yl]-1-[3-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: N-[4-(dimethylamino)-5-phenyl-pyrimidin-2-yl]-1-[3-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-[4-(dimethylamino)-5-phenyl-pyrimidin-2-yl]-1-[3-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-[4-(dimethylamino)-5-phenyl-2-pyrimidinyl]-1-[3-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-[4-(dimethylamino)-5-phenylpyrimidin-2-yl]-1-[3-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-[4-(dimethylamino)-5-phenyl-pyrimidin-2-yl]-1-[3-(trifluoromethyl)phenyl]isonipecotamide Formula: C25H26F3N5O MolecularWeight: 469.50205

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC=C1C2=CC=CC=C2)NC(=O)C3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CN(C)C1=NC(=NC=C1C2=CC=CC=C2)NC(=O)C3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C25H26F3N5O/c1-32(2)22-21(17-7-4-3-5-8-17)16-29-24(30-22)31-23(34)18-11-13-33(14-12-18)20-10-6-9-19(15-20)25(26,27)28/h3-10,15-16,18H,11-14H2,1-2H3,(H,29,30,31,34)