5-oxidanylidene-7-pyridin-4-yl-1H-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile

Systemtic Name: 5-oxidanylidene-7-pyridin-4-yl-1H-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile Openeye Name: 5-oxo-7-(4-pyridyl)-1H-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile CAS Name: 5-oxo-7-pyridin-4-yl-1H-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile IUPAC Name: 5-oxo-7-pyridin-4-yl-1H-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile Traditional Name: 5-keto-7-(4-pyridyl)-1H-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile Formula: C11H6N6O MolecularWeight: 238.20494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1C2=C(C(=O)N3C=NNC3=N2)C#N

Isomeric SMILES

C1=CN=CC=C1C2=C(C(=O)N3C=NNC3=N2)C#N

InChI

InChI=1S/C11H6N6O/c12-5-8-9(7-1-3-13-4-2-7)15-11-16-14-6-17(11)10(8)18/h1-4,6H,(H,15,16)