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

Systemtic Name: N-[4-bromanyl-3-(trifluoromethyl)phenyl]-4-(3-chloranylpyridin-2-yl)-2-methyl-piperazine-1-carboxamide Openeye Name: N-[4-bromo-3-(trifluoromethyl)phenyl]-4-(3-chloro-2-pyridyl)-2-methyl-piperazine-1-carboxamide CAS Name: N-[4-bromo-3-(trifluoromethyl)phenyl]-4-(3-chloro-2-pyridinyl)-2-methyl-1-piperazinecarboxamide IUPAC Name: N-[4-bromo-3-(trifluoromethyl)phenyl]-4-(3-chloropyridin-2-yl)-2-methylpiperazine-1-carboxamide Traditional Name: N-[4-bromo-3-(trifluoromethyl)phenyl]-4-(3-chloro-2-pyridyl)-2-methyl-piperazine-1-carboxamide Formula: C18H17BrClF3N4O MolecularWeight: 477.70599

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17BrClF3N4O/c1-11-10-26(16-15(20)3-2-6-24-16)7-8-27(11)17(28)25-12-4-5-14(19)13(9-12)18(21,22)23/h2-6,9,11H,7-8,10H2,1H3,(H,25,28)