(2S)-2-[(4-bromophenyl)sulfonylamino]-N-[(4-fluoranyl-3-methyl-phenyl)methyl]-3-methyl-butanamide

Systemtic Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-N-[(4-fluoranyl-3-methyl-phenyl)methyl]-3-methyl-butanamide Openeye Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-N-[(4-fluoro-3-methyl-phenyl)methyl]-3-methyl-butanamide CAS Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-N-[(4-fluoro-3-methylphenyl)methyl]-3-methylbutanamide IUPAC Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-N-[(4-fluoro-3-methylphenyl)methyl]-3-methylbutanamide Traditional Name: (2S)-2-(brosylamino)-N-(4-fluoro-3-methyl-benzyl)-3-methyl-butyramide Formula: C19H22BrFN2O3S MolecularWeight: 457.356983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)C(C(C)C)NS(=O)(=O)C2=CC=C(C=C2)Br)F

Isomeric SMILES

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

InChI

InChI=1S/C19H22BrFN2O3S/c1-12(2)18(23-27(25,26)16-7-5-15(20)6-8-16)19(24)22-11-14-4-9-17(21)13(3)10-14/h4-10,12,18,23H,11H2,1-3H3,(H,22,24)/t18-/m0/s1