2-tert-butyl-4-(3-chloranylpyridin-2-yl)-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide

Systemtic Name: 2-tert-butyl-4-(3-chloranylpyridin-2-yl)-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Openeye Name: 2-tert-butyl-4-(3-chloro-2-pyridyl)-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide CAS Name: 2-tert-butyl-4-(3-chloro-2-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1-piperazinecarboxamide IUPAC Name: 2-tert-butyl-4-(3-chloropyridin-2-yl)-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Traditional Name: 2-tert-butyl-4-(3-chloro-2-pyridyl)-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Formula: C21H24ClF3N4O MolecularWeight: 440.88967

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CN(CCN1C(=O)NC2=CC=C(C=C2)C(F)(F)F)C3=C(C=CC=N3)Cl

Isomeric SMILES

CC(C)(C)C1CN(CCN1C(=O)NC2=CC=C(C=C2)C(F)(F)F)C3=C(C=CC=N3)Cl

InChI

InChI=1S/C21H24ClF3N4O/c1-20(2,3)17-13-28(18-16(22)5-4-10-26-18)11-12-29(17)19(30)27-15-8-6-14(7-9-15)21(23,24)25/h4-10,17H,11-13H2,1-3H3,(H,27,30)