diethyl 3-methyl-5-[2-(2,3,5-trimethylphenoxy)ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[2-(2,3,5-trimethylphenoxy)ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[2-(2,3,5-trimethylphenoxy)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[1-oxo-2-(2,3,5-trimethylphenoxy)ethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[2-(2,3,5-trimethylphenoxy)acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(2,3,5-trimethylphenoxy)acetyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C22H27NO6S MolecularWeight: 433.51788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27NO6S/c1-7-27-21(25)18-15(6)19(22(26)28-8-2)30-20(18)23-17(24)11-29-16-10-12(3)9-13(4)14(16)5/h9-10H,7-8,11H2,1-6H3,(H,23,24)