3-[[4-(3-pyridazin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-[[4-(3-pyridazin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methyl]benzenecarbonitrile Openeye Name: 3-[[4-(3-pyridazin-4-yl-1,2,4-oxadiazol-5-yl)-1-piperidyl]methyl]benzonitrile CAS Name: 3-[[4-[3-(4-pyridazinyl)-1,2,4-oxadiazol-5-yl]-1-piperidinyl]methyl]benzonitrile IUPAC Name: 3-[[4-(3-pyridazin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methyl]benzonitrile Traditional Name: 3-[[4-(3-pyridazin-4-yl-1,2,4-oxadiazol-5-yl)piperidino]methyl]benzonitrile Formula: C19H18N6O MolecularWeight: 346.38582

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=NO2)C3=CN=NC=C3)CC4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN(CCC1C2=NC(=NO2)C3=CN=NC=C3)CC4=CC=CC(=C4)C#N

InChI

InChI=1S/C19H18N6O/c20-11-14-2-1-3-15(10-14)13-25-8-5-16(6-9-25)19-23-18(24-26-19)17-4-7-21-22-12-17/h1-4,7,10,12,16H,5-6,8-9,13H2