4-(3-cyanopyridin-2-yl)-2-methyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide

Systemtic Name: 4-(3-cyanopyridin-2-yl)-2-methyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Openeye Name: 4-(3-cyano-2-pyridyl)-2-methyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide CAS Name: 4-(3-cyano-2-pyridinyl)-2-methyl-N-[4-(trifluoromethyl)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-(3-cyanopyridin-2-yl)-2-methyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Traditional Name: 4-(3-cyano-2-pyridyl)-2-methyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Formula: C19H18F3N5O MolecularWeight: 389.37433

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)NC2=CC=C(C=C2)C(F)(F)F)C3=C(C=CC=N3)C#N

Isomeric SMILES

CC1CN(CCN1C(=O)NC2=CC=C(C=C2)C(F)(F)F)C3=C(C=CC=N3)C#N

InChI

InChI=1S/C19H18F3N5O/c1-13-12-26(17-14(11-23)3-2-8-24-17)9-10-27(13)18(28)25-16-6-4-15(5-7-16)19(20,21)22/h2-8,13H,9-10,12H2,1H3,(H,25,28)