(2-oxidanylidene-2-thiophen-2-yl-ethyl) (2R)-2-[(4-bromophenyl)amino]-4-oxidanylidene-4-phenyl-butanoate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) (2R)-2-[(4-bromophenyl)amino]-4-oxidanylidene-4-phenyl-butanoate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] (2R)-2-(4-bromoanilino)-4-oxo-4-phenyl-butanoate CAS Name: (2R)-2-(4-bromoanilino)-4-oxo-4-phenylbutanoic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) (2R)-2-(4-bromoanilino)-4-oxo-4-phenylbutanoate Traditional Name: (2R)-2-(4-bromoanilino)-4-keto-4-phenyl-butyric acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C22H18BrNO4S MolecularWeight: 472.35162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CC(C(=O)OCC(=O)C2=CC=CS2)NC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C[C@H](C(=O)OCC(=O)C2=CC=CS2)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C22H18BrNO4S/c23-16-8-10-17(11-9-16)24-18(13-19(25)15-5-2-1-3-6-15)22(27)28-14-20(26)21-7-4-12-29-21/h1-12,18,24H,13-14H2/t18-/m1/s1