ethyl 4-(4-bromophenyl)-2-(2,2-diphenylethanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-bromophenyl)-2-(2,2-diphenylethanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(4-bromophenyl)-2-[(2,2-diphenylacetyl)amino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[(1-oxo-2,2-diphenylethyl)amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromophenyl)-2-[(2,2-diphenylacetyl)amino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[(2,2-diphenylacetyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C27H22BrNO3S MolecularWeight: 520.43748

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)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H22BrNO3S/c1-2-32-27(31)24-22(18-13-15-21(28)16-14-18)17-33-26(24)29-25(30)23(19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-17,23H,2H2,1H3,(H,29,30)