ethyl 2-[2-(2,4,6-trimethylphenyl)ethanoylamino]-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(2,4,6-trimethylphenyl)ethanoylamino]-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(2,4,6-trimethylphenyl)acetyl]amino]benzothiophene-3-carboxylate CAS Name: 2-[[1-oxo-2-(2,4,6-trimethylphenyl)ethyl]amino]-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2,4,6-trimethylphenyl)acetyl]amino]-1-benzothiophene-3-carboxylate Traditional Name: 2-[(2-mesitylacetyl)amino]benzothiophene-3-carboxylic acid ethyl ester Formula: C22H23NO3S MolecularWeight: 381.48792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)CC3=C(C=C(C=C3C)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)CC3=C(C=C(C=C3C)C)C

InChI

InChI=1S/C22H23NO3S/c1-5-26-22(25)20-16-8-6-7-9-18(16)27-21(20)23-19(24)12-17-14(3)10-13(2)11-15(17)4/h6-11H,5,12H2,1-4H3,(H,23,24)