[2-(4-benzamidophenyl)-2-oxidanylidene-ethyl] 3-phenylsulfanylpropanoate

Systemtic Name: [2-(4-benzamidophenyl)-2-oxidanylidene-ethyl] 3-phenylsulfanylpropanoate Openeye Name: [2-(4-benzamidophenyl)-2-oxo-ethyl] 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid [2-(4-benzamidophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-benzamidophenyl)-2-oxoethyl] 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid [2-(4-benzamidophenyl)-2-keto-ethyl] ester Formula: C24H21NO4S MolecularWeight: 419.49284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)COC(=O)CCSC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)COC(=O)CCSC3=CC=CC=C3

InChI

InChI=1S/C24H21NO4S/c26-22(17-29-23(27)15-16-30-21-9-5-2-6-10-21)18-11-13-20(14-12-18)25-24(28)19-7-3-1-4-8-19/h1-14H,15-17H2,(H,25,28)