ethyl 5-ethyl-2-[2-[4-(3-oxidanylidenebutyl)phenoxy]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[2-[4-(3-oxidanylidenebutyl)phenoxy]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[[2-[4-(3-oxobutyl)phenoxy]acetyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[1-oxo-2-[4-(3-oxobutyl)phenoxy]ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[[2-[4-(3-oxobutyl)phenoxy]acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[2-[4-(3-ketobutyl)phenoxy]acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)COC2=CC=C(C=C2)CCC(=O)C)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)COC2=CC=C(C=C2)CCC(=O)C)C(=O)OCC

InChI

InChI=1S/C21H25NO5S/c1-4-17-12-18(21(25)26-5-2)20(28-17)22-19(24)13-27-16-10-8-15(9-11-16)7-6-14(3)23/h8-12H,4-7,13H2,1-3H3,(H,22,24)