N-pentyl-5-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]pyrazine-2-carboxamide

Systemtic Name: N-pentyl-5-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]pyrazine-2-carboxamide Openeye Name: N-pentyl-5-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyrazine-2-carboxamide CAS Name: 5-[4-[oxo-[2-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-N-pentyl-2-pyrazinecarboxamide IUPAC Name: N-pentyl-5-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyrazine-2-carboxamide Traditional Name: N-amyl-5-[4-[2-(trifluoromethyl)benzoyl]piperazino]pyrazinamide Formula: C22H26F3N5O2 MolecularWeight: 449.46935

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CN=C(C=N1)N2CCN(CC2)C(=O)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CCCCCNC(=O)C1=CN=C(C=N1)N2CCN(CC2)C(=O)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C22H26F3N5O2/c1-2-3-6-9-26-20(31)18-14-28-19(15-27-18)29-10-12-30(13-11-29)21(32)16-7-4-5-8-17(16)22(23,24)25/h4-5,7-8,14-15H,2-3,6,9-13H2,1H3,(H,26,31)