(2S)-N-(3-ethanoylphenyl)-4-methylsulfanyl-2-(phenylsulfonylamino)butanamide

Systemtic Name: (2S)-N-(3-ethanoylphenyl)-4-methylsulfanyl-2-(phenylsulfonylamino)butanamide Openeye Name: (2S)-N-(3-acetylphenyl)-2-(benzenesulfonamido)-4-methylsulfanyl-butanamide CAS Name: (2S)-N-(3-acetylphenyl)-2-(benzenesulfonamido)-4-(methylthio)butanamide IUPAC Name: (2S)-N-(3-acetylphenyl)-2-(benzenesulfonamido)-4-methylsulfanylbutanamide Traditional Name: (2S)-N-(3-acetylphenyl)-2-(benzenesulfonamido)-4-(methylthio)butyramide Formula: C19H22N2O4S2 MolecularWeight: 406.51898

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C(CCSC)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)[C@H](CCSC)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H22N2O4S2/c1-14(22)15-7-6-8-16(13-15)20-19(23)18(11-12-26-2)21-27(24,25)17-9-4-3-5-10-17/h3-10,13,18,21H,11-12H2,1-2H3,(H,20,23)/t18-/m0/s1