[2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl] (2S)-3-methyl-2-(phenylsulfonylamino)butanoate

Systemtic Name: [2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl] (2S)-3-methyl-2-(phenylsulfonylamino)butanoate Openeye Name: [2-oxo-2-(3-sulfamoylanilino)ethyl] (2S)-2-(benzenesulfonamido)-3-methyl-butanoate CAS Name: (2S)-2-(benzenesulfonamido)-3-methylbutanoic acid [2-oxo-2-(3-sulfamoylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(3-sulfamoylanilino)ethyl] (2S)-2-(benzenesulfonamido)-3-methylbutanoate Traditional Name: (2S)-2-(benzenesulfonamido)-3-methyl-butyric acid [2-keto-2-(3-sulfamoylanilino)ethyl] ester Formula: C19H23N3O7S2 MolecularWeight: 469.53182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NC1=CC(=CC=C1)S(=O)(=O)N)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)NC1=CC(=CC=C1)S(=O)(=O)N)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H23N3O7S2/c1-13(2)18(22-31(27,28)15-8-4-3-5-9-15)19(24)29-12-17(23)21-14-7-6-10-16(11-14)30(20,25)26/h3-11,13,18,22H,12H2,1-2H3,(H,21,23)(H2,20,25,26)/t18-/m0/s1