[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 3,5-dimethyl-1,2-oxazole-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 3,5-dimethyl-1,2-oxazole-4-carboxylate Openeye Name: [2-oxo-2-(2-thienylmethylamino)ethyl] 3,5-dimethylisoxazole-4-carboxylate CAS Name: 3,5-dimethyl-4-isoxazolecarboxylic acid [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 3,5-dimethyl-1,2-oxazole-4-carboxylate Traditional Name: 3,5-dimethylisoxazole-4-carboxylic acid [2-keto-2-(2-thenylamino)ethyl] ester Formula: C13H14N2O4S MolecularWeight: 294.32626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)OCC(=O)NCC2=CC=CS2

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)OCC(=O)NCC2=CC=CS2

InChI

InChI=1S/C13H14N2O4S/c1-8-12(9(2)19-15-8)13(17)18-7-11(16)14-6-10-4-3-5-20-10/h3-5H,6-7H2,1-2H3,(H,14,16)