methyl 2-[2-(3,4-dimethylphenoxy)ethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(3,4-dimethylphenoxy)ethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(3,4-dimethylphenoxy)acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-(3,4-dimethylphenoxy)-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(3,4-dimethylphenoxy)acetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(3,4-dimethylphenoxy)acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C22H21NO4S MolecularWeight: 395.47144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OC)C

InChI

InChI=1S/C22H21NO4S/c1-14-9-10-17(11-15(14)2)27-12-19(24)23-21-20(22(25)26-3)18(13-28-21)16-7-5-4-6-8-16/h4-11,13H,12H2,1-3H3,(H,23,24)