6-(3-bromanyl-4,5-dimethoxy-phenyl)-2-[(4-chlorophenyl)amino]-4-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-(3-bromanyl-4,5-dimethoxy-phenyl)-2-[(4-chlorophenyl)amino]-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(3-bromo-4,5-dimethoxy-phenyl)-2-(4-chloroanilino)-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 6-(3-bromo-4,5-dimethoxyphenyl)-2-(4-chloroanilino)-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(3-bromo-4,5-dimethoxyphenyl)-2-(4-chloroanilino)-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 6-(3-bromo-4,5-dimethoxy-phenyl)-2-(4-chloroanilino)-4-keto-1H-pyrimidine-5-carbonitrile Formula: C19H14BrClN4O3 MolecularWeight: 461.69646

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2=C(C(=O)N=C(N2)NC3=CC=C(C=C3)Cl)C#N)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C2=C(C(=O)N=C(N2)NC3=CC=C(C=C3)Cl)C#N)Br)OC

InChI

InChI=1S/C19H14BrClN4O3/c1-27-15-8-10(7-14(20)17(15)28-2)16-13(9-22)18(26)25-19(24-16)23-12-5-3-11(21)4-6-12/h3-8H,1-2H3,(H2,23,24,25,26)