ethyl 4-[[2-(4-acetamidophenyl)sulfanyl-2-phenyl-ethanoyl]amino]benzoate

Systemtic Name: ethyl 4-[[2-(4-acetamidophenyl)sulfanyl-2-phenyl-ethanoyl]amino]benzoate Openeye Name: ethyl 4-[[2-(4-acetamidophenyl)sulfanyl-2-phenyl-acetyl]amino]benzoate CAS Name: 4-[[2-[(4-acetamidophenyl)thio]-1-oxo-2-phenylethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(4-acetamidophenyl)sulfanyl-2-phenylacetyl]amino]benzoate Traditional Name: 4-[[2-[(4-acetamidophenyl)thio]-2-phenyl-acetyl]amino]benzoic acid ethyl ester Formula: C25H24N2O4S MolecularWeight: 448.53406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C25H24N2O4S/c1-3-31-25(30)19-9-11-21(12-10-19)27-24(29)23(18-7-5-4-6-8-18)32-22-15-13-20(14-16-22)26-17(2)28/h4-16,23H,3H2,1-2H3,(H,26,28)(H,27,29)