ethyl 4,5-dimethyl-2-[2-(5-propan-2-yl-1-benzofuran-3-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-[2-(5-propan-2-yl-1-benzofuran-3-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(5-isopropylbenzofuran-3-yl)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[1-oxo-2-(5-propan-2-yl-3-benzofuranyl)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[[2-(5-propan-2-yl-1-benzofuran-3-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-(5-isopropylbenzofuran-3-yl)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H25NO4S MolecularWeight: 399.5032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CC2=COC3=C2C=C(C=C3)C(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CC2=COC3=C2C=C(C=C3)C(C)C

InChI

InChI=1S/C22H25NO4S/c1-6-26-22(25)20-13(4)14(5)28-21(20)23-19(24)10-16-11-27-18-8-7-15(12(2)3)9-17(16)18/h7-9,11-12H,6,10H2,1-5H3,(H,23,24)