[2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl] 3-phenylsulfanylpropanoate

Systemtic Name: [2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl] 3-phenylsulfanylpropanoate Openeye Name: [2-oxo-2-(3-sulfamoylanilino)ethyl] 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid [2-oxo-2-(3-sulfamoylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(3-sulfamoylanilino)ethyl] 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid [2-keto-2-(3-sulfamoylanilino)ethyl] ester Formula: C17H18N2O5S2 MolecularWeight: 394.46522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCC(=O)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)SCCC(=O)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N

InChI

InChI=1S/C17H18N2O5S2/c18-26(22,23)15-8-4-5-13(11-15)19-16(20)12-24-17(21)9-10-25-14-6-2-1-3-7-14/h1-8,11H,9-10,12H2,(H,19,20)(H2,18,22,23)