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

Systemtic Name: 4-(5-azanyl-3-chloranyl-pyridin-2-yl)-2-methyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Openeye Name: 4-(5-amino-3-chloro-2-pyridyl)-2-methyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide CAS Name: 4-(5-amino-3-chloro-2-pyridinyl)-2-methyl-N-[4-(trifluoromethyl)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-(5-amino-3-chloropyridin-2-yl)-2-methyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Traditional Name: 4-(5-amino-3-chloro-2-pyridyl)-2-methyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Formula: C18H19ClF3N5O MolecularWeight: 413.82457

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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=C(C=N3)N)Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H19ClF3N5O/c1-11-10-26(16-15(19)8-13(23)9-24-16)6-7-27(11)17(28)25-14-4-2-12(3-5-14)18(20,21)22/h2-5,8-9,11H,6-7,10,23H2,1H3,(H,25,28)