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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)COC2=CC=C(C=C2)CCC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)COC2=CC=C(C=C2)CCC(=O)C

InChI

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