ethyl 5-ethyl-4-methyl-2-[2-[2-(2-oxidanylideneazepan-1-yl)ethanoyloxy]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-4-methyl-2-[2-[2-(2-oxidanylideneazepan-1-yl)ethanoyloxy]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-4-methyl-2-[[2-[2-(2-oxoazepan-1-yl)acetyl]oxyacetyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-4-methyl-2-[[1-oxo-2-[1-oxo-2-(2-oxo-1-azepanyl)ethoxy]ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-4-methyl-2-[[2-[2-(2-oxoazepan-1-yl)acetyl]oxyacetyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[2-[2-(2-ketoazepan-1-yl)acetyl]oxyacetyl]amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H28N2O6S MolecularWeight: 424.51112

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(S1)NC(=O)COC(=O)CN2CCCCCC2=O)C(=O)OCC)C

Isomeric SMILES

CCC1=C(C(=C(S1)NC(=O)COC(=O)CN2CCCCCC2=O)C(=O)OCC)C

InChI

InChI=1S/C20H28N2O6S/c1-4-14-13(3)18(20(26)27-5-2)19(29-14)21-15(23)12-28-17(25)11-22-10-8-6-7-9-16(22)24/h4-12H2,1-3H3,(H,21,23)