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

Systemtic Name: 4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-N-heptan-2-yl-piperazine-1-carboxamide Openeye Name: 4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N-(1-methylhexyl)piperazine-1-carboxamide CAS Name: 4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-heptan-2-yl-1-piperazinecarboxamide IUPAC Name: 4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-heptan-2-ylpiperazine-1-carboxamide Traditional Name: 4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N-(1-methylhexyl)piperazine-1-carboxamide Formula: C18H26ClF3N4O MolecularWeight: 406.87345

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)N1CCN(CC1)C2=C(C=C(C=N2)C(F)(F)F)Cl

Isomeric SMILES

CCCCCC(C)NC(=O)N1CCN(CC1)C2=C(C=C(C=N2)C(F)(F)F)Cl

InChI

InChI=1S/C18H26ClF3N4O/c1-3-4-5-6-13(2)24-17(27)26-9-7-25(8-10-26)16-15(19)11-14(12-23-16)18(20,21)22/h11-13H,3-10H2,1-2H3,(H,24,27)