[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 4-(prop-2-enylsulfamoyl)benzoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 4-(prop-2-enylsulfamoyl)benzoate Openeye Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 4-(allylsulfamoyl)benzoate CAS Name: 4-(prop-2-enylsulfamoyl)benzoic acid [2-oxo-2-[3-(phenylthio)propylamino]ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 4-(prop-2-enylsulfamoyl)benzoate Traditional Name: 4-(allylsulfamoyl)benzoic acid [2-keto-2-[3-(phenylthio)propylamino]ethyl] ester Formula: C21H24N2O5S2 MolecularWeight: 448.55566

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC(=O)NCCCSC2=CC=CC=C2

Isomeric SMILES

C=CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC(=O)NCCCSC2=CC=CC=C2

InChI

InChI=1S/C21H24N2O5S2/c1-2-13-23-30(26,27)19-11-9-17(10-12-19)21(25)28-16-20(24)22-14-6-15-29-18-7-4-3-5-8-18/h2-5,7-12,23H,1,6,13-16H2,(H,22,24)