3-[5-[[3-(2-methoxypyridin-4-yl)-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidin-8-yl]methyl]-1,2,4-oxadiazol-3-yl]benzenecarbonitrile

Systemtic Name: 3-[5-[[3-(2-methoxypyridin-4-yl)-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidin-8-yl]methyl]-1,2,4-oxadiazol-3-yl]benzenecarbonitrile Openeye Name: 3-[5-[[3-(2-methoxy-4-pyridyl)-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidin-8-yl]methyl]-1,2,4-oxadiazol-3-yl]benzonitrile CAS Name: 3-[5-[[3-(2-methoxy-4-pyridinyl)-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidin-8-yl]methyl]-1,2,4-oxadiazol-3-yl]benzonitrile IUPAC Name: 3-[5-[[3-(2-methoxypyridin-4-yl)-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidin-8-yl]methyl]-1,2,4-oxadiazol-3-yl]benzonitrile Traditional Name: 3-[5-[[3-(2-methoxy-4-pyridyl)-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrimidin-8-yl]methyl]-1,2,4-oxadiazol-3-yl]benzonitrile Formula: C21H18N8O2 MolecularWeight: 414.42002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=CC(=C1)C2=NN=C3N2CCCN3CC4=NC(=NO4)C5=CC=CC(=C5)C#N

Isomeric SMILES

COC1=NC=CC(=C1)C2=NN=C3N2CCCN3CC4=NC(=NO4)C5=CC=CC(=C5)C#N

InChI

InChI=1S/C21H18N8O2/c1-30-17-11-16(6-7-23-17)20-25-26-21-28(8-3-9-29(20)21)13-18-24-19(27-31-18)15-5-2-4-14(10-15)12-22/h2,4-7,10-11H,3,8-9,13H2,1H3