ethyl 6-[[1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[[1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[1-(3-methylsulfanylphenyl)-5-oxo-pyrrolidine-3-carbonyl]oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[[1-[3-(methylthio)phenyl]-5-oxo-3-pyrrolidinyl]-oxomethoxy]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[1-(3-methylsulfanylphenyl)-5-oxopyrrolidine-3-carbonyl]oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-6-[[5-keto-1-[3-(methylthio)phenyl]pyrrolidine-3-carbonyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H23N3O6S MolecularWeight: 433.47812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)COC(=O)C2CC(=O)N(C2)C3=CC(=CC=C3)SC

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)COC(=O)C2CC(=O)N(C2)C3=CC(=CC=C3)SC

InChI

InChI=1S/C20H23N3O6S/c1-3-28-19(26)15-9-21-20(27)22-16(15)11-29-18(25)12-7-17(24)23(10-12)13-5-4-6-14(8-13)30-2/h4-6,8,12H,3,7,9-11H2,1-2H3,(H2,21,22,27)