(2S)-N-(1H-benzimidazol-2-yl)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-butanamide

Systemtic Name: (2S)-N-(1H-benzimidazol-2-yl)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-butanamide Openeye Name: (2S)-N-(1H-benzimidazol-2-yl)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-butanamide CAS Name: (2S)-N-(1H-benzimidazol-2-yl)-2-[(4-bromophenyl)sulfonylamino]-3-methylbutanamide IUPAC Name: (2S)-N-(1H-benzimidazol-2-yl)-2-[(4-bromophenyl)sulfonylamino]-3-methylbutanamide Traditional Name: (2S)-N-(1H-benzimidazol-2-yl)-2-(brosylamino)-3-methyl-butyramide Formula: C18H19BrN4O3S MolecularWeight: 451.33746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=NC2=CC=CC=C2N1)NS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=NC2=CC=CC=C2N1)NS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H19BrN4O3S/c1-11(2)16(23-27(25,26)13-9-7-12(19)8-10-13)17(24)22-18-20-14-5-3-4-6-15(14)21-18/h3-11,16,23H,1-2H3,(H2,20,21,22,24)/t16-/m0/s1