ethyl 4-(2-methylpropyl)-2-[2-(4-oxidanylidene-4-thiophen-2-yl-butanoyl)oxyethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(2-methylpropyl)-2-[2-(4-oxidanylidene-4-thiophen-2-yl-butanoyl)oxyethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-isobutyl-2-[[2-[4-oxo-4-(2-thienyl)butanoyl]oxyacetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[2-(1,4-dioxo-4-thiophen-2-ylbutoxy)-1-oxoethyl]amino]-4-(2-methylpropyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-methylpropyl)-2-[[2-(4-oxo-4-thiophen-2-ylbutanoyl)oxyacetyl]amino]thiophene-3-carboxylate Traditional Name: 4-isobutyl-2-[[2-[4-keto-4-(2-thienyl)butanoyl]oxyacetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H25NO6S2 MolecularWeight: 451.5563

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1CC(C)C)NC(=O)COC(=O)CCC(=O)C2=CC=CS2

Isomeric SMILES

CCOC(=O)C1=C(SC=C1CC(C)C)NC(=O)COC(=O)CCC(=O)C2=CC=CS2

InChI

InChI=1S/C21H25NO6S2/c1-4-27-21(26)19-14(10-13(2)3)12-30-20(19)22-17(24)11-28-18(25)8-7-15(23)16-6-5-9-29-16/h5-6,9,12-13H,4,7-8,10-11H2,1-3H3,(H,22,24)