methyl 3-[1,1-bis(oxidanylidene)thiolan-3-yl]-6-(4-methoxycarbonylphenyl)-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 3-[1,1-bis(oxidanylidene)thiolan-3-yl]-6-(4-methoxycarbonylphenyl)-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 3-(1,1-dioxothiolan-3-yl)-6-(4-methoxycarbonylphenyl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-(1,1-dioxo-3-thiolanyl)-6-(4-methoxycarbonylphenyl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 3-(1,1-dioxothiolan-3-yl)-6-(4-methoxycarbonylphenyl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(4-carbomethoxyphenyl)-3-(1,1-diketothiolan-3-yl)-2-keto-4-methyl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C19H22N2O7S MolecularWeight: 422.45218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1C2CCS(=O)(=O)C2)C3=CC=C(C=C3)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=C(C(NC(=O)N1C2CCS(=O)(=O)C2)C3=CC=C(C=C3)C(=O)OC)C(=O)OC

InChI

InChI=1S/C19H22N2O7S/c1-11-15(18(23)28-3)16(12-4-6-13(7-5-12)17(22)27-2)20-19(24)21(11)14-8-9-29(25,26)10-14/h4-7,14,16H,8-10H2,1-3H3,(H,20,24)