(2S)-N-(4-bromanyl-3-methyl-phenyl)-3-methyl-2-(phenylsulfonylamino)butanamide

Systemtic Name: (2S)-N-(4-bromanyl-3-methyl-phenyl)-3-methyl-2-(phenylsulfonylamino)butanamide Openeye Name: (2S)-2-(benzenesulfonamido)-N-(4-bromo-3-methyl-phenyl)-3-methyl-butanamide CAS Name: (2S)-2-(benzenesulfonamido)-N-(4-bromo-3-methylphenyl)-3-methylbutanamide IUPAC Name: (2S)-2-(benzenesulfonamido)-N-(4-bromo-3-methylphenyl)-3-methylbutanamide Traditional Name: (2S)-2-(benzenesulfonamido)-N-(4-bromo-3-methyl-phenyl)-3-methyl-butyramide Formula: C18H21BrN2O3S MolecularWeight: 425.33994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C(C(C)C)NS(=O)(=O)C2=CC=CC=C2)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)[C@H](C(C)C)NS(=O)(=O)C2=CC=CC=C2)Br

InChI

InChI=1S/C18H21BrN2O3S/c1-12(2)17(21-25(23,24)15-7-5-4-6-8-15)18(22)20-14-9-10-16(19)13(3)11-14/h4-12,17,21H,1-3H3,(H,20,22)/t17-/m0/s1