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

Systemtic Name: 2-[(4-chlorophenyl)amino]-4-oxidanylidene-6-(3-phenylmethoxyphenyl)-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(3-benzyloxyphenyl)-2-(4-chloroanilino)-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 2-(4-chloroanilino)-4-oxo-6-(3-phenylmethoxyphenyl)-1H-pyrimidine-5-carbonitrile IUPAC Name: 2-(4-chloroanilino)-4-oxo-6-(3-phenylmethoxyphenyl)-1H-pyrimidine-5-carbonitrile Traditional Name: 6-(3-benzoxyphenyl)-2-(4-chloroanilino)-4-keto-1H-pyrimidine-5-carbonitrile Formula: C24H17ClN4O2 MolecularWeight: 428.87038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)C3=C(C(=O)N=C(N3)NC4=CC=C(C=C4)Cl)C#N

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)C3=C(C(=O)N=C(N3)NC4=CC=C(C=C4)Cl)C#N

InChI

InChI=1S/C24H17ClN4O2/c25-18-9-11-19(12-10-18)27-24-28-22(21(14-26)23(30)29-24)17-7-4-8-20(13-17)31-15-16-5-2-1-3-6-16/h1-13H,15H2,(H2,27,28,29,30)