3-azanyl-N-[[1-pyrimidin-2-yl-4-[3-(trifluoromethyl)phenyl]piperidin-4-yl]methyl]pyrazine-2-carboxamide

Systemtic Name: 3-azanyl-N-[[1-pyrimidin-2-yl-4-[3-(trifluoromethyl)phenyl]piperidin-4-yl]methyl]pyrazine-2-carboxamide Openeye Name: 3-amino-N-[[1-pyrimidin-2-yl-4-[3-(trifluoromethyl)phenyl]-4-piperidyl]methyl]pyrazine-2-carboxamide CAS Name: 3-amino-N-[[1-(2-pyrimidinyl)-4-[3-(trifluoromethyl)phenyl]-4-piperidinyl]methyl]-2-pyrazinecarboxamide IUPAC Name: 3-amino-N-[[1-pyrimidin-2-yl-4-[3-(trifluoromethyl)phenyl]piperidin-4-yl]methyl]pyrazine-2-carboxamide Traditional Name: 3-amino-N-[[1-(2-pyrimidyl)-4-[3-(trifluoromethyl)phenyl]-4-piperidyl]methyl]pyrazinamide Formula: C22H22F3N7O MolecularWeight: 457.45159

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CNC(=O)C2=NC=CN=C2N)C3=CC(=CC=C3)C(F)(F)F)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCC1(CNC(=O)C2=NC=CN=C2N)C3=CC(=CC=C3)C(F)(F)F)C4=NC=CC=N4

InChI

InChI=1S/C22H22F3N7O/c23-22(24,25)16-4-1-3-15(13-16)21(14-31-19(33)17-18(26)28-10-9-27-17)5-11-32(12-6-21)20-29-7-2-8-30-20/h1-4,7-10,13H,5-6,11-12,14H2,(H2,26,28)(H,31,33)