ethyl 5-ethanoyl-4-methyl-2-[2-(2,3,6-trimethylphenoxy)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethanoyl-4-methyl-2-[2-(2,3,6-trimethylphenoxy)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-4-methyl-2-[[2-(2,3,6-trimethylphenoxy)acetyl]amino]thiophene-3-carboxylate CAS Name: 5-acetyl-4-methyl-2-[[1-oxo-2-(2,3,6-trimethylphenoxy)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-4-methyl-2-[[2-(2,3,6-trimethylphenoxy)acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-acetyl-4-methyl-2-[[2-(2,3,6-trimethylphenoxy)acetyl]amino]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(=O)C)NC(=O)COC2=C(C=CC(=C2C)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)COC2=C(C=CC(=C2C)C)C

InChI

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