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

Systemtic Name: methyl (4S)-4-(2,4-dimethoxyphenyl)-2-oxidanylidene-5-(phenylcarbonyl)-3,4-dihydro-1H-pyrimidine-6-carboxylate Openeye Name: methyl (4S)-5-benzoyl-4-(2,4-dimethoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-6-carboxylate CAS Name: (4S)-5-benzoyl-4-(2,4-dimethoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl (4S)-5-benzoyl-4-(2,4-dimethoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-6-carboxylate Traditional Name: (4S)-5-benzoyl-4-(2,4-dimethoxyphenyl)-2-keto-3,4-dihydro-1H-pyrimidine-6-carboxylic acid methyl ester Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2C(=C(NC(=O)N2)C(=O)OC)C(=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)[C@H]2C(=C(NC(=O)N2)C(=O)OC)C(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C21H20N2O6/c1-27-13-9-10-14(15(11-13)28-2)17-16(19(24)12-7-5-4-6-8-12)18(20(25)29-3)23-21(26)22-17/h4-11,17H,1-3H3,(H2,22,23,26)/t17-/m0/s1