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

Systemtic Name: 4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-N-pentan-2-yl-piperazine-1-carboxamide Openeye Name: 4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N-(1-methylbutyl)piperazine-1-carboxamide CAS Name: 4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-pentan-2-yl-1-piperazinecarboxamide IUPAC Name: 4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-pentan-2-ylpiperazine-1-carboxamide Traditional Name: 4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N-(1-methylbutyl)piperazine-1-carboxamide Formula: C16H22ClF3N4O MolecularWeight: 378.82029

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22ClF3N4O/c1-3-4-11(2)22-15(25)24-7-5-23(6-8-24)14-13(17)9-12(10-21-14)16(18,19)20/h9-11H,3-8H2,1-2H3,(H,22,25)