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

Systemtic Name: [(4S)-5-ethoxycarbonyl-4-(4-methoxyphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl]methyl 5-methylpyrazine-2-carboxylate Openeye Name: [(4S)-5-ethoxycarbonyl-4-(4-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl 5-methylpyrazine-2-carboxylate CAS Name: 5-methyl-2-pyrazinecarboxylic acid [(4S)-5-ethoxycarbonyl-4-(4-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl ester IUPAC Name: [(4S)-5-ethoxycarbonyl-4-(4-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl 5-methylpyrazine-2-carboxylate Traditional Name: 5-methylpyrazinic acid [(4S)-5-carbethoxy-2-keto-4-(4-methoxyphenyl)-3,4-dihydro-1H-pyrimidin-6-yl]methyl ester Formula: C21H22N4O6 MolecularWeight: 426.42258

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)OC)COC(=O)C3=CN=C(C=N3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@H]1C2=CC=C(C=C2)OC)COC(=O)C3=CN=C(C=N3)C

InChI

InChI=1S/C21H22N4O6/c1-4-30-20(27)17-16(11-31-19(26)15-10-22-12(2)9-23-15)24-21(28)25-18(17)13-5-7-14(29-3)8-6-13/h5-10,18H,4,11H2,1-3H3,(H2,24,25,28)/t18-/m0/s1