6-(4-ethylphenyl)-2-oxidanylidene-1H-pyrimidine-4-carbonitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CC(=NC(=O)N2)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CC(=NC(=O)N2)C#N

InChI

InChI=1S/C13H11N3O/c1-2-9-3-5-10(6-4-9)12-7-11(8-14)15-13(17)16-12/h3-7H,2H2,1H3,(H,15,16,17)