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

Systemtic Name: [2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate Openeye Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 3-ethyl-5-methyl-isoxazole-4-carboxylate CAS Name: 3-ethyl-5-methyl-4-isoxazolecarboxylic acid [2-oxo-2-[2-(phenylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate Traditional Name: 3-ethyl-5-methyl-isoxazole-4-carboxylic acid [2-keto-2-[2-(phenylthio)ethylamino]ethyl] ester Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C(=O)OCC(=O)NCCSC2=CC=CC=C2)C

Isomeric SMILES

CCC1=NOC(=C1C(=O)OCC(=O)NCCSC2=CC=CC=C2)C

InChI

InChI=1S/C17H20N2O4S/c1-3-14-16(12(2)23-19-14)17(21)22-11-15(20)18-9-10-24-13-7-5-4-6-8-13/h4-8H,3,9-11H2,1-2H3,(H,18,20)