ethyl 4-methyl-2-oxidanylidene-6-[[2-(oxolan-2-ylmethylsulfanyl)phenyl]carbonyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-oxidanylidene-6-[[2-(oxolan-2-ylmethylsulfanyl)phenyl]carbonyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-methyl-2-oxo-6-[[2-(tetrahydrofuran-2-ylmethylsulfanyl)benzoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-methyl-2-oxo-6-[[oxo-[2-(2-oxolanylmethylthio)phenyl]methoxy]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-oxo-6-[[2-(oxolan-2-ylmethylsulfanyl)benzoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-4-methyl-6-[[2-(tetrahydrofurfurylthio)benzoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)COC(=O)C2=CC=CC=C2SCC3CCCO3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C)COC(=O)C2=CC=CC=C2SCC3CCCO3

InChI

InChI=1S/C21H26N2O6S/c1-3-27-20(25)18-13(2)22-21(26)23-16(18)11-29-19(24)15-8-4-5-9-17(15)30-12-14-7-6-10-28-14/h4-5,8-9,13-14H,3,6-7,10-12H2,1-2H3,(H2,22,23,26)