ethyl 4-(4-bromophenyl)-2-[2-(3,4-dimethylphenoxy)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-bromophenyl)-2-[2-(3,4-dimethylphenoxy)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-bromophenyl)-2-[[2-(3,4-dimethylphenoxy)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[2-(3,4-dimethylphenoxy)-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromophenyl)-2-[[2-(3,4-dimethylphenoxy)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[[2-(3,4-dimethylphenoxy)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C23H22BrNO4S MolecularWeight: 488.39408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)COC3=CC(=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)COC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C23H22BrNO4S/c1-4-28-23(27)21-19(16-6-8-17(24)9-7-16)13-30-22(21)25-20(26)12-29-18-10-5-14(2)15(3)11-18/h5-11,13H,4,12H2,1-3H3,(H,25,26)