ethyl 7-(4-bromophenyl)-6-oxidanylidene-3-phenyl-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: ethyl 7-(4-bromophenyl)-6-oxidanylidene-3-phenyl-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: ethyl 7-(4-bromophenyl)-6-oxo-3-phenyl-thieno[2,3-b]pyridine-2-carboxylate CAS Name: 7-(4-bromophenyl)-6-oxo-3-phenyl-2-thieno[2,3-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-(4-bromophenyl)-6-oxo-3-phenylthieno[2,3-b]pyridine-2-carboxylate Traditional Name: 7-(4-bromophenyl)-6-keto-3-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester Formula: C22H16BrNO3S MolecularWeight: 454.33634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N(C(=O)C=C2)C3=CC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N(C(=O)C=C2)C3=CC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C22H16BrNO3S/c1-2-27-22(26)20-19(14-6-4-3-5-7-14)17-12-13-18(25)24(21(17)28-20)16-10-8-15(23)9-11-16/h3-13H,2H2,1H3