(2S)-4-methylsulfanyl-2-(2-phenoxyethanoylamino)-N-(4-sulfamoylphenyl)butanamide

Systemtic Name: (2S)-4-methylsulfanyl-2-(2-phenoxyethanoylamino)-N-(4-sulfamoylphenyl)butanamide Openeye Name: (2S)-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]-N-(4-sulfamoylphenyl)butanamide CAS Name: (2S)-4-(methylthio)-2-[(1-oxo-2-phenoxyethyl)amino]-N-(4-sulfamoylphenyl)butanamide IUPAC Name: (2S)-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]-N-(4-sulfamoylphenyl)butanamide Traditional Name: (2S)-4-(methylthio)-2-[(2-phenoxyacetyl)amino]-N-(4-sulfamoylphenyl)butyramide Formula: C19H23N3O5S2 MolecularWeight: 437.53302

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CSCC[C@@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C19H23N3O5S2/c1-28-12-11-17(22-18(23)13-27-15-5-3-2-4-6-15)19(24)21-14-7-9-16(10-8-14)29(20,25)26/h2-10,17H,11-13H2,1H3,(H,21,24)(H,22,23)(H2,20,25,26)/t17-/m0/s1