4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(4-fluorophenyl)-2,6-dimethyl-piperazine-1-carboxamide

Systemtic Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(4-fluorophenyl)-2,6-dimethyl-piperazine-1-carboxamide Openeye Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(4-fluorophenyl)-2,6-dimethyl-piperazine-1-carboxamide CAS Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(4-fluorophenyl)-2,6-dimethyl-1-piperazinecarboxamide IUPAC Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(4-fluorophenyl)-2,6-dimethylpiperazine-1-carboxamide Traditional Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(4-fluorophenyl)-2,6-dimethyl-piperazine-1-carboxamide Formula: C21H20F4N4O MolecularWeight: 420.403313

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1C(=O)NC2=CC=C(C=C2)F)C)C3=CC(=C(C=C3)C#N)C(F)(F)F

Isomeric SMILES

CC1CN(CC(N1C(=O)NC2=CC=C(C=C2)F)C)C3=CC(=C(C=C3)C#N)C(F)(F)F

InChI

InChI=1S/C21H20F4N4O/c1-13-11-28(18-8-3-15(10-26)19(9-18)21(23,24)25)12-14(2)29(13)20(30)27-17-6-4-16(22)5-7-17/h3-9,13-14H,11-12H2,1-2H3,(H,27,30)