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

Systemtic Name: ethyl (4S)-6-(1-benzothiophen-2-ylcarbonyloxymethyl)-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-6-(benzothiophene-2-carbonyloxymethyl)-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-[[1-benzothiophen-2-yl(oxo)methoxy]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-6-(1-benzothiophene-2-carbonyloxymethyl)-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-(benzothiophene-2-carbonyloxymethyl)-4-ethyl-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)COC(=O)C2=CC3=CC=CC=C3S2)C(=O)OCC

Isomeric SMILES

CC[C@H]1C(=C(NC(=O)N1)COC(=O)C2=CC3=CC=CC=C3S2)C(=O)OCC

InChI

InChI=1S/C19H20N2O5S/c1-3-12-16(18(23)25-4-2)13(21-19(24)20-12)10-26-17(22)15-9-11-7-5-6-8-14(11)27-15/h5-9,12H,3-4,10H2,1-2H3,(H2,20,21,24)/t12-/m0/s1