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

Systemtic Name: 6-(2,5-dimethylphenyl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(2,5-dimethylphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 6-(2,5-dimethylphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(2,5-dimethylphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 6-(2,5-dimethylphenyl)-4-keto-1H-pyrimidine-5-carbonitrile Formula: C13H11N3O MolecularWeight: 225.24594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=C(C(=O)N=CN2)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=C(C(=O)N=CN2)C#N

InChI

InChI=1S/C13H11N3O/c1-8-3-4-9(2)10(5-8)12-11(6-14)13(17)16-7-15-12/h3-5,7H,1-2H3,(H,15,16,17)