[(4S)-5-ethoxycarbonyl-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl]methyl quinoxaline-6-carboxylate

Systemtic Name: [(4S)-5-ethoxycarbonyl-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl]methyl quinoxaline-6-carboxylate Openeye Name: [(4S)-5-ethoxycarbonyl-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl quinoxaline-6-carboxylate CAS Name: 6-quinoxalinecarboxylic acid [(4S)-5-ethoxycarbonyl-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl ester IUPAC Name: [(4S)-5-ethoxycarbonyl-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl quinoxaline-6-carboxylate Traditional Name: quinoxaline-6-carboxylic acid [(4S)-5-carbethoxy-4-ethyl-2-keto-3,4-dihydro-1H-pyrimidin-6-yl]methyl ester Formula: C19H20N4O5 MolecularWeight: 384.3859

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)COC(=O)C2=CC3=NC=CN=C3C=C2)C(=O)OCC

Isomeric SMILES

CC[C@H]1C(=C(NC(=O)N1)COC(=O)C2=CC3=NC=CN=C3C=C2)C(=O)OCC

InChI

InChI=1S/C19H20N4O5/c1-3-12-16(18(25)27-4-2)15(23-19(26)22-12)10-28-17(24)11-5-6-13-14(9-11)21-8-7-20-13/h5-9,12H,3-4,10H2,1-2H3,(H2,22,23,26)/t12-/m0/s1