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

Systemtic Name: 1-(6-chloranylpyridazin-3-yl)-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-(6-chloropyridazin-3-yl)-N-[2-morpholino-5-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: 1-(6-chloro-3-pyridazinyl)-N-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(6-chloropyridazin-3-yl)-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(6-chloropyridazin-3-yl)-N-[2-morpholino-5-(trifluoromethyl)phenyl]isonipecotamide Formula: C21H23ClF3N5O2 MolecularWeight: 469.88783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCOCC3)C4=NN=C(C=C4)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCOCC3)C4=NN=C(C=C4)Cl

InChI

InChI=1S/C21H23ClF3N5O2/c22-18-3-4-19(28-27-18)30-7-5-14(6-8-30)20(31)26-16-13-15(21(23,24)25)1-2-17(16)29-9-11-32-12-10-29/h1-4,13-14H,5-12H2,(H,26,31)