1-(6-chloranylpyridazin-3-yl)-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(6-chloranylpyridazin-3-yl)-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-(6-chloropyridazin-3-yl)-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: 1-(6-chloro-3-pyridazinyl)-N-[2-(1-pyrazolyl)-5-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(6-chloropyridazin-3-yl)-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(6-chloropyridazin-3-yl)-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]isonipecotamide Formula: C20H18ClF3N6O MolecularWeight: 450.84473

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3C=CC=N3)C4=NN=C(C=C4)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3C=CC=N3)C4=NN=C(C=C4)Cl

InChI

InChI=1S/C20H18ClF3N6O/c21-17-4-5-18(28-27-17)29-10-6-13(7-11-29)19(31)26-15-12-14(20(22,23)24)2-3-16(15)30-9-1-8-25-30/h1-5,8-9,12-13H,6-7,10-11H2,(H,26,31)