[2-oxidanylidene-2-(pyrimidin-2-ylamino)ethyl] 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(pyrimidin-2-ylamino)ethyl] 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate Openeye Name: [2-oxo-2-(pyrimidin-2-ylamino)ethyl] 5-methyl-3-phenyl-isoxazole-4-carboxylate CAS Name: 5-methyl-3-phenyl-4-isoxazolecarboxylic acid [2-oxo-2-(2-pyrimidinylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pyrimidin-2-ylamino)ethyl] 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate Traditional Name: 5-methyl-3-phenyl-isoxazole-4-carboxylic acid [2-keto-2-(2-pyrimidylamino)ethyl] ester Formula: C17H14N4O4 MolecularWeight: 338.31746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC(=O)NC3=NC=CC=N3

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC(=O)NC3=NC=CC=N3

InChI

InChI=1S/C17H14N4O4/c1-11-14(15(21-25-11)12-6-3-2-4-7-12)16(23)24-10-13(22)20-17-18-8-5-9-19-17/h2-9H,10H2,1H3,(H,18,19,20,22)