2-[(3-chlorophenyl)amino]-4-(4-methoxyphenyl)-6-oxidanylidene-4,5-dihydro-1H-pyrimidine-5-carbonitrile

Systemtic Name: 2-[(3-chlorophenyl)amino]-4-(4-methoxyphenyl)-6-oxidanylidene-4,5-dihydro-1H-pyrimidine-5-carbonitrile Openeye Name: 2-(3-chloroanilino)-4-(4-methoxyphenyl)-6-oxo-4,5-dihydro-1H-pyrimidine-5-carbonitrile CAS Name: 2-(3-chloroanilino)-4-(4-methoxyphenyl)-6-oxo-4,5-dihydro-1H-pyrimidine-5-carbonitrile IUPAC Name: 2-(3-chloroanilino)-4-(4-methoxyphenyl)-6-oxo-4,5-dihydro-1H-pyrimidine-5-carbonitrile Traditional Name: 2-(3-chloroanilino)-6-keto-4-(4-methoxyphenyl)-4,5-dihydro-1H-pyrimidine-5-carbonitrile Formula: C18H15ClN4O2 MolecularWeight: 354.7903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C(=O)NC(=N2)NC3=CC(=CC=C3)Cl)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2C(C(=O)NC(=N2)NC3=CC(=CC=C3)Cl)C#N

InChI

InChI=1S/C18H15ClN4O2/c1-25-14-7-5-11(6-8-14)16-15(10-20)17(24)23-18(22-16)21-13-4-2-3-12(19)9-13/h2-9,15-16H,1H3,(H2,21,22,23,24)