2-[(4-fluorophenyl)amino]-6-(4-methylphenyl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 2-[(4-fluorophenyl)amino]-6-(4-methylphenyl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 2-(4-fluoroanilino)-4-oxo-6-(p-tolyl)-1H-pyrimidine-5-carbonitrile CAS Name: 2-(4-fluoroanilino)-6-(4-methylphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 2-(4-fluoroanilino)-6-(4-methylphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 2-(4-fluoroanilino)-4-keto-6-(p-tolyl)-1H-pyrimidine-5-carbonitrile Formula: C18H13FN4O MolecularWeight: 320.320423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=O)N=C(N2)NC3=CC=C(C=C3)F)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=O)N=C(N2)NC3=CC=C(C=C3)F)C#N

InChI

InChI=1S/C18H13FN4O/c1-11-2-4-12(5-3-11)16-15(10-20)17(24)23-18(22-16)21-14-8-6-13(19)7-9-14/h2-9H,1H3,(H2,21,22,23,24)