(2S)-N-(2-methylphenyl)-4-methylsulfonyl-2-(phenylsulfonylamino)butanamide

Systemtic Name: (2S)-N-(2-methylphenyl)-4-methylsulfonyl-2-(phenylsulfonylamino)butanamide Openeye Name: (2S)-2-(benzenesulfonamido)-4-methylsulfonyl-N-(o-tolyl)butanamide CAS Name: (2S)-2-(benzenesulfonamido)-N-(2-methylphenyl)-4-methylsulfonylbutanamide IUPAC Name: (2S)-2-(benzenesulfonamido)-N-(2-methylphenyl)-4-methylsulfonylbutanamide Traditional Name: (2S)-2-(benzenesulfonamido)-4-mesyl-N-(o-tolyl)butyramide Formula: C18H22N2O5S2 MolecularWeight: 410.50768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(CCS(=O)(=O)C)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=CC=C1NC(=O)[C@H](CCS(=O)(=O)C)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H22N2O5S2/c1-14-8-6-7-11-16(14)19-18(21)17(12-13-26(2,22)23)20-27(24,25)15-9-4-3-5-10-15/h3-11,17,20H,12-13H2,1-2H3,(H,19,21)/t17-/m0/s1