ethyl 4-[[2-(3-acetamidophenyl)sulfanyl-2-phenyl-ethanoyl]amino]benzoate

Systemtic Name: ethyl 4-[[2-(3-acetamidophenyl)sulfanyl-2-phenyl-ethanoyl]amino]benzoate Openeye Name: ethyl 4-[[2-(3-acetamidophenyl)sulfanyl-2-phenyl-acetyl]amino]benzoate CAS Name: 4-[[2-[(3-acetamidophenyl)thio]-1-oxo-2-phenylethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(3-acetamidophenyl)sulfanyl-2-phenylacetyl]amino]benzoate Traditional Name: 4-[[2-[(3-acetamidophenyl)thio]-2-phenyl-acetyl]amino]benzoic acid ethyl ester Formula: C25H24N2O4S MolecularWeight: 448.53406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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