ethyl 6-(1-benzothiophen-3-ylcarbonyloxymethyl)-4-(5-methylfuran-2-yl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-(1-benzothiophen-3-ylcarbonyloxymethyl)-4-(5-methylfuran-2-yl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-(benzothiophene-3-carbonyloxymethyl)-4-(5-methyl-2-furyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[1-benzothiophen-3-yl(oxo)methoxy]methyl]-4-(5-methyl-2-furanyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(1-benzothiophene-3-carbonyloxymethyl)-4-(5-methylfuran-2-yl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-(benzothiophene-3-carbonyloxymethyl)-2-keto-4-(5-methyl-2-furyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H20N2O6S MolecularWeight: 440.469

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(O2)C)COC(=O)C3=CSC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(O2)C)COC(=O)C3=CSC4=CC=CC=C43

InChI

InChI=1S/C22H20N2O6S/c1-3-28-21(26)18-15(23-22(27)24-19(18)16-9-8-12(2)30-16)10-29-20(25)14-11-31-17-7-5-4-6-13(14)17/h4-9,11,19H,3,10H2,1-2H3,(H2,23,24,27)