8-methyl-7-oxidanylidene-5-phenyl-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile

Systemtic Name: 8-methyl-7-oxidanylidene-5-phenyl-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile Openeye Name: 8-methyl-7-oxo-5-phenyl-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile CAS Name: 8-methyl-7-oxo-5-phenyl-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile IUPAC Name: 8-methyl-7-oxo-5-phenyl-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile Traditional Name: 7-keto-8-methyl-5-phenyl-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile Formula: C13H9N5O MolecularWeight: 251.24346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N2C1=NN=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

CN1C(=O)C(=C(N2C1=NN=C2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C13H9N5O/c1-17-12(19)10(7-14)11(9-5-3-2-4-6-9)18-8-15-16-13(17)18/h2-6,8H,1H3