methyl 4-[[5-cyano-6-(4-methoxyphenyl)-4-oxidanylidene-1H-pyrimidin-2-yl]amino]benzoate

Systemtic Name: methyl 4-[[5-cyano-6-(4-methoxyphenyl)-4-oxidanylidene-1H-pyrimidin-2-yl]amino]benzoate Openeye Name: methyl 4-[[5-cyano-6-(4-methoxyphenyl)-4-oxo-1H-pyrimidin-2-yl]amino]benzoate CAS Name: 4-[[5-cyano-6-(4-methoxyphenyl)-4-oxo-1H-pyrimidin-2-yl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[5-cyano-6-(4-methoxyphenyl)-4-oxo-1H-pyrimidin-2-yl]amino]benzoate Traditional Name: 4-[[5-cyano-4-keto-6-(4-methoxyphenyl)-1H-pyrimidin-2-yl]amino]benzoic acid methyl ester Formula: C20H16N4O4 MolecularWeight: 376.36544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16N4O4/c1-27-15-9-5-12(6-10-15)17-16(11-21)18(25)24-20(23-17)22-14-7-3-13(4-8-14)19(26)28-2/h3-10H,1-2H3,(H2,22,23,24,25)