ethyl 6-[3-(4-methylphenyl)sulfonylpropanoyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[3-(4-methylphenyl)sulfonylpropanoyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-oxo-6-[3-(p-tolylsulfonyl)propanoyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[3-(4-methylphenyl)sulfonyl-1-oxopropoxy]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[3-(4-methylphenyl)sulfonylpropanoyloxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-6-(3-tosylpropanoyloxymethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H22N2O7S MolecularWeight: 410.44148

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)COC(=O)CCS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)COC(=O)CCS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C18H22N2O7S/c1-3-26-17(22)14-10-19-18(23)20-15(14)11-27-16(21)8-9-28(24,25)13-6-4-12(2)5-7-13/h4-7H,3,8-11H2,1-2H3,(H2,19,20,23)