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

Systemtic Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(4-fluorophenyl)-3-methyl-piperazine-1-carboxamide Openeye Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(4-fluorophenyl)-3-methyl-piperazine-1-carboxamide CAS Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(4-fluorophenyl)-3-methyl-1-piperazinecarboxamide IUPAC Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(4-fluorophenyl)-3-methylpiperazine-1-carboxamide Traditional Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(4-fluorophenyl)-3-methyl-piperazine-1-carboxamide Formula: C20H18F4N4O MolecularWeight: 406.376733

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC(=C(C=C2)C#N)C(F)(F)F)C(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CC1CN(CCN1C2=CC(=C(C=C2)C#N)C(F)(F)F)C(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C20H18F4N4O/c1-13-12-27(19(29)26-16-5-3-15(21)4-6-16)8-9-28(13)17-7-2-14(11-25)18(10-17)20(22,23)24/h2-7,10,13H,8-9,12H2,1H3,(H,26,29)