(2S)-2-[(4-bromophenyl)sulfonylamino]-N-(2-methyl-5-nitro-phenyl)propanamide

Systemtic Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-N-(2-methyl-5-nitro-phenyl)propanamide Openeye Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-N-(2-methyl-5-nitro-phenyl)propanamide CAS Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-N-(2-methyl-5-nitrophenyl)propanamide IUPAC Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-N-(2-methyl-5-nitrophenyl)propanamide Traditional Name: (2S)-2-(brosylamino)-N-(2-methyl-5-nitro-phenyl)propionamide Formula: C16H16BrN3O5S MolecularWeight: 442.28434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(C)NS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

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

InChI

InChI=1S/C16H16BrN3O5S/c1-10-3-6-13(20(22)23)9-15(10)18-16(21)11(2)19-26(24,25)14-7-4-12(17)5-8-14/h3-9,11,19H,1-2H3,(H,18,21)/t11-/m0/s1