[(2R)-1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl] 3-(4-methylphenyl)sulfanylpropanoate

Systemtic Name: [(2R)-1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl] 3-(4-methylphenyl)sulfanylpropanoate Openeye Name: [(1R)-1-methyl-2-oxo-2-(4-sulfamoylanilino)ethyl] 3-(p-tolylsulfanyl)propanoate CAS Name: 3-[(4-methylphenyl)thio]propanoic acid [(2R)-1-oxo-1-(4-sulfamoylanilino)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(4-sulfamoylanilino)propan-2-yl] 3-(4-methylphenyl)sulfanylpropanoate Traditional Name: 3-(p-tolylthio)propionic acid [(1R)-2-keto-1-methyl-2-(4-sulfamoylanilino)ethyl] ester Formula: C19H22N2O5S2 MolecularWeight: 422.51838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)OC(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)O[C@H](C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C19H22N2O5S2/c1-13-3-7-16(8-4-13)27-12-11-18(22)26-14(2)19(23)21-15-5-9-17(10-6-15)28(20,24)25/h3-10,14H,11-12H2,1-2H3,(H,21,23)(H2,20,24,25)/t14-/m1/s1