ethyl 4-(3,4-dimethylphenyl)-2-[2-(2-prop-2-enylphenoxy)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(3,4-dimethylphenyl)-2-[2-(2-prop-2-enylphenoxy)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(2-allylphenoxy)acetyl]amino]-4-(3,4-dimethylphenyl)thiophene-3-carboxylate CAS Name: 4-(3,4-dimethylphenyl)-2-[[1-oxo-2-(2-prop-2-enylphenoxy)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,4-dimethylphenyl)-2-[[2-(2-prop-2-enylphenoxy)acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-(2-allylphenoxy)acetyl]amino]-4-(3,4-dimethylphenyl)thiophene-3-carboxylic acid ethyl ester Formula: C26H27NO4S MolecularWeight: 449.56188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)C)C)NC(=O)COC3=CC=CC=C3CC=C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)C)C)NC(=O)COC3=CC=CC=C3CC=C

InChI

InChI=1S/C26H27NO4S/c1-5-9-19-10-7-8-11-22(19)31-15-23(28)27-25-24(26(29)30-6-2)21(16-32-25)20-13-12-17(3)18(4)14-20/h5,7-8,10-14,16H,1,6,9,15H2,2-4H3,(H,27,28)