ethyl 5-ethyl-2-(3-oxidanylidenebutanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-(3-oxidanylidenebutanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-(3-oxobutanoylamino)thiophene-3-carboxylate CAS Name: 2-(1,3-dioxobutylamino)-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-(3-oxobutanoylamino)thiophene-3-carboxylate Traditional Name: 2-(acetoacetylamino)-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CC(=O)C)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CC(=O)C)C(=O)OCC

InChI

InChI=1S/C13H17NO4S/c1-4-9-7-10(13(17)18-5-2)12(19-9)14-11(16)6-8(3)15/h7H,4-6H2,1-3H3,(H,14,16)