methyl (4S)-4-(4-methoxycarbonylphenyl)-2-oxidanylidene-5-(phenylcarbonyl)-3,4-dihydro-1H-pyrimidine-6-carboxylate

Systemtic Name: methyl (4S)-4-(4-methoxycarbonylphenyl)-2-oxidanylidene-5-(phenylcarbonyl)-3,4-dihydro-1H-pyrimidine-6-carboxylate Openeye Name: methyl (4S)-5-benzoyl-4-(4-methoxycarbonylphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-6-carboxylate CAS Name: (4S)-5-benzoyl-4-(4-methoxycarbonylphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl (4S)-5-benzoyl-4-(4-methoxycarbonylphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-6-carboxylate Traditional Name: (4S)-5-benzoyl-4-(4-carbomethoxyphenyl)-2-keto-3,4-dihydro-1H-pyrimidine-6-carboxylic acid methyl ester Formula: C21H18N2O6 MolecularWeight: 394.37742

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2C(=C(NC(=O)N2)C(=O)OC)C(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)[C@H]2C(=C(NC(=O)N2)C(=O)OC)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H18N2O6/c1-28-19(25)14-10-8-12(9-11-14)16-15(18(24)13-6-4-3-5-7-13)17(20(26)29-2)23-21(27)22-16/h3-11,16H,1-2H3,(H2,22,23,27)/t16-/m0/s1