4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-N-(2-ethylhexyl)piperazine-1-carboxamide

Systemtic Name: 4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-N-(2-ethylhexyl)piperazine-1-carboxamide Openeye Name: 4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N-(2-ethylhexyl)piperazine-1-carboxamide CAS Name: 4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(2-ethylhexyl)-1-piperazinecarboxamide IUPAC Name: 4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-(2-ethylhexyl)piperazine-1-carboxamide Traditional Name: 4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N-(2-ethylhexyl)piperazine-1-carboxamide Formula: C19H28ClF3N4O MolecularWeight: 420.90003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)N1CCN(CC1)C2=C(C=C(C=N2)C(F)(F)F)Cl

Isomeric SMILES

CCCCC(CC)CNC(=O)N1CCN(CC1)C2=C(C=C(C=N2)C(F)(F)F)Cl

InChI

InChI=1S/C19H28ClF3N4O/c1-3-5-6-14(4-2)12-25-18(28)27-9-7-26(8-10-27)17-16(20)11-15(13-24-17)19(21,22)23/h11,13-14H,3-10,12H2,1-2H3,(H,25,28)