N-[3-(3-methylphenoxy)propyl]-1-[3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide

Systemtic Name: N-[3-(3-methylphenoxy)propyl]-1-[3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide Openeye Name: N-[3-(3-methylphenoxy)propyl]-1-[3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide CAS Name: N-[3-(3-methylphenoxy)propyl]-1-[3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidinecarboxamide IUPAC Name: N-[3-(3-methylphenoxy)propyl]-1-[3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide Traditional Name: N-[3-(3-methylphenoxy)propyl]-1-[3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]isonipecotamide Formula: C22H25F3N6O2 MolecularWeight: 462.46811

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCNC(=O)C2CCN(CC2)C3=NN4C(=NN=C4C(F)(F)F)C=C3

Isomeric SMILES

CC1=CC(=CC=C1)OCCCNC(=O)C2CCN(CC2)C3=NN4C(=NN=C4C(F)(F)F)C=C3

InChI

InChI=1S/C22H25F3N6O2/c1-15-4-2-5-17(14-15)33-13-3-10-26-20(32)16-8-11-30(12-9-16)19-7-6-18-27-28-21(22(23,24)25)31(18)29-19/h2,4-7,14,16H,3,8-13H2,1H3,(H,26,32)