N-[3-[2-[(4-chlorophenyl)amino]-5-cyano-4-oxidanylidene-1H-pyrimidin-6-yl]phenyl]-2,4-dimethoxy-benzamide

Systemtic Name: N-[3-[2-[(4-chlorophenyl)amino]-5-cyano-4-oxidanylidene-1H-pyrimidin-6-yl]phenyl]-2,4-dimethoxy-benzamide Openeye Name: N-[3-[2-(4-chloroanilino)-5-cyano-4-oxo-1H-pyrimidin-6-yl]phenyl]-2,4-dimethoxy-benzamide CAS Name: N-[3-[2-(4-chloroanilino)-5-cyano-4-oxo-1H-pyrimidin-6-yl]phenyl]-2,4-dimethoxybenzamide IUPAC Name: N-[3-[2-(4-chloroanilino)-5-cyano-4-oxo-1H-pyrimidin-6-yl]phenyl]-2,4-dimethoxybenzamide Traditional Name: N-[3-[2-(4-chloroanilino)-5-cyano-4-keto-1H-pyrimidin-6-yl]phenyl]-2,4-dimethoxy-benzamide Formula: C26H20ClN5O4 MolecularWeight: 501.9211

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=C(C(=O)N=C(N3)NC4=CC=C(C=C4)Cl)C#N)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=C(C(=O)N=C(N3)NC4=CC=C(C=C4)Cl)C#N)OC

InChI

InChI=1S/C26H20ClN5O4/c1-35-19-10-11-20(22(13-19)36-2)24(33)29-18-5-3-4-15(12-18)23-21(14-28)25(34)32-26(31-23)30-17-8-6-16(27)7-9-17/h3-13H,1-2H3,(H,29,33)(H2,30,31,32,34)