4-[4-cyano-3-(trifluoromethyl)phenyl]-3-ethyl-N-(4-fluorophenyl)piperazine-1-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CCN1C2=CC(=C(C=C2)C#N)C(F)(F)F)C(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CCC1CN(CCN1C2=CC(=C(C=C2)C#N)C(F)(F)F)C(=O)NC3=CC=C(C=C3)F

InChI

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