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

Systemtic Name: ethyl 3-[1,1-bis(oxidanylidene)thiolan-3-yl]-6-(4-methoxycarbonylphenyl)-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C20H24N2O7S MolecularWeight: 436.47876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=C(C=C2)C(=O)OC)C3CCS(=O)(=O)C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=C(C=C2)C(=O)OC)C3CCS(=O)(=O)C3)C

InChI

InChI=1S/C20H24N2O7S/c1-4-29-19(24)16-12(2)22(15-9-10-30(26,27)11-15)20(25)21-17(16)13-5-7-14(8-6-13)18(23)28-3/h5-8,15,17H,4,9-11H2,1-3H3,(H,21,25)