ethyl 4-ethyl-5-methyl-2-[2-(4-propan-2-ylphenyl)carbonyloxyethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-ethyl-5-methyl-2-[2-(4-propan-2-ylphenyl)carbonyloxyethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-ethyl-2-[[2-(4-isopropylbenzoyl)oxyacetyl]amino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[1-oxo-2-[oxo-(4-propan-2-ylphenyl)methoxy]ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-5-methyl-2-[[2-(4-propan-2-ylbenzoyl)oxyacetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[(2-cumoyloxyacetyl)amino]-4-ethyl-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H27NO5S MolecularWeight: 417.51848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=O)COC(=O)C2=CC=C(C=C2)C(C)C)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=O)COC(=O)C2=CC=C(C=C2)C(C)C)C

InChI

InChI=1S/C22H27NO5S/c1-6-17-14(5)29-20(19(17)22(26)27-7-2)23-18(24)12-28-21(25)16-10-8-15(9-11-16)13(3)4/h8-11,13H,6-7,12H2,1-5H3,(H,23,24)