1-(3-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-4-piperidin-1-yl-piperidine-4-carboxamide

Systemtic Name: 1-(3-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-4-piperidin-1-yl-piperidine-4-carboxamide Openeye Name: 1-(3-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-4-(1-piperidyl)piperidine-4-carboxamide CAS Name: 1-(3-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-4-(1-piperidinyl)-4-piperidinecarboxamide IUPAC Name: 1-(3-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-4-piperidin-1-ylpiperidine-4-carboxamide Traditional Name: 1-(3-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-4-piperidino-isonipecotamide Formula: C22H27N7O MolecularWeight: 405.49608

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2(CCN(CC2)C3=NN4C(=NN=C4C5=CC=CC=C5)C=C3)C(=O)N

Isomeric SMILES

C1CCN(CC1)C2(CCN(CC2)C3=NN4C(=NN=C4C5=CC=CC=C5)C=C3)C(=O)N

InChI

InChI=1S/C22H27N7O/c23-21(30)22(28-13-5-2-6-14-28)11-15-27(16-12-22)19-10-9-18-24-25-20(29(18)26-19)17-7-3-1-4-8-17/h1,3-4,7-10H,2,5-6,11-16H2,(H2,23,30)