2-(4-methylphenyl)-6-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 2-(4-methylphenyl)-6-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 6-oxo-2-(p-tolyl)-1H-pyrimidine-5-carbonitrile CAS Name: 2-(4-methylphenyl)-6-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 2-(4-methylphenyl)-6-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 6-keto-2-(p-tolyl)-1H-pyrimidine-5-carbonitrile Formula: C12H9N3O MolecularWeight: 211.21936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC=C(C(=O)N2)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC=C(C(=O)N2)C#N

InChI

InChI=1S/C12H9N3O/c1-8-2-4-9(5-3-8)11-14-7-10(6-13)12(16)15-11/h2-5,7H,1H3,(H,14,15,16)