(2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-[2-(2-methylpropanoylamino)ethyl]butanamide

Systemtic Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-[2-(2-methylpropanoylamino)ethyl]butanamide Openeye Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-[2-(2-methylpropanoylamino)ethyl]butanamide CAS Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]butanamide IUPAC Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-[2-(2-methylpropanoylamino)ethyl]butanamide Traditional Name: (2S)-2-(brosylamino)-N-[2-(isobutyrylamino)ethyl]-3-methyl-butyramide Formula: C17H26BrN3O4S MolecularWeight: 448.37504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCNC(=O)C(C)C)NS(=O)(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CC(C)[C@@H](C(=O)NCCNC(=O)C(C)C)NS(=O)(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C17H26BrN3O4S/c1-11(2)15(17(23)20-10-9-19-16(22)12(3)4)21-26(24,25)14-7-5-13(18)6-8-14/h5-8,11-12,15,21H,9-10H2,1-4H3,(H,19,22)(H,20,23)/t15-/m0/s1