(5-ethoxycarbonyl-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl)methyl 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate

Systemtic Name: (5-ethoxycarbonyl-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl)methyl 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate Openeye Name: (5-ethoxycarbonyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl)methyl 3-ethyl-5-methyl-isoxazole-4-carboxylate CAS Name: 3-ethyl-5-methyl-4-isoxazolecarboxylic acid (5-ethoxycarbonyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl)methyl ester IUPAC Name: (5-ethoxycarbonyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl)methyl 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate Traditional Name: 3-ethyl-5-methyl-isoxazole-4-carboxylic acid (5-carbethoxy-2-keto-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl)methyl ester Formula: C21H23N3O6 MolecularWeight: 413.42382

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C(=O)OCC2=C(C(NC(=O)N2)C3=CC=CC=C3)C(=O)OCC)C

Isomeric SMILES

CCC1=NOC(=C1C(=O)OCC2=C(C(NC(=O)N2)C3=CC=CC=C3)C(=O)OCC)C

InChI

InChI=1S/C21H23N3O6/c1-4-14-16(12(3)30-24-14)19(25)29-11-15-17(20(26)28-5-2)18(23-21(27)22-15)13-9-7-6-8-10-13/h6-10,18H,4-5,11H2,1-3H3,(H2,22,23,27)