ethyl 5-phenyl-2-[2-(2,3,6-trimethylphenoxy)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-phenyl-2-[2-(2,3,6-trimethylphenoxy)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-phenyl-2-[[2-(2,3,6-trimethylphenoxy)acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[1-oxo-2-(2,3,6-trimethylphenoxy)ethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-phenyl-2-[[2-(2,3,6-trimethylphenoxy)acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-phenyl-2-[[2-(2,3,6-trimethylphenoxy)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C24H25NO4S MolecularWeight: 423.5246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)COC3=C(C=CC(=C3C)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)COC3=C(C=CC(=C3C)C)C

InChI

InChI=1S/C24H25NO4S/c1-5-28-24(27)19-13-20(18-9-7-6-8-10-18)30-23(19)25-21(26)14-29-22-16(3)12-11-15(2)17(22)4/h6-13H,5,14H2,1-4H3,(H,25,26)