N-phenethyl-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperidine-3-carboxamide

Systemtic Name: N-phenethyl-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperidine-3-carboxamide Openeye Name: 1-(3-isopropyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-N-phenethyl-piperidine-3-carboxamide CAS Name: N-phenethyl-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-3-piperidinecarboxamide IUPAC Name: N-phenethyl-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperidine-3-carboxamide Traditional Name: 1-(3-isopropyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-N-phenethyl-nipecotamide Formula: C22H28N6O MolecularWeight: 392.49732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C2N1N=C(C=C2)N3CCCC(C3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=NN=C2N1N=C(C=C2)N3CCCC(C3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C22H28N6O/c1-16(2)21-25-24-19-10-11-20(26-28(19)21)27-14-6-9-18(15-27)22(29)23-13-12-17-7-4-3-5-8-17/h3-5,7-8,10-11,16,18H,6,9,12-15H2,1-2H3,(H,23,29)