(2S)-2-[(4-bromophenyl)sulfonylamino]-N'-oxidanyl-N-(4-phenyl-1,3-thiazol-2-yl)octanediamide

Systemtic Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-N'-oxidanyl-N-(4-phenyl-1,3-thiazol-2-yl)octanediamide Openeye Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-8-(hydroxyamino)-8-oxo-N-(4-phenylthiazol-2-yl)octanamide CAS Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-N'-hydroxy-N-(4-phenyl-2-thiazolyl)octanediamide IUPAC Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-N'-hydroxy-N-(4-phenyl-1,3-thiazol-2-yl)octanediamide Traditional Name: (2S)-2-(brosylamino)-8-(hydroxyamino)-8-keto-N-(4-phenylthiazol-2-yl)caprylamide Formula: C23H25BrN4O5S2 MolecularWeight: 581.5024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C(CCCCCC(=O)NO)NS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)[C@H](CCCCCC(=O)NO)NS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C23H25BrN4O5S2/c24-17-11-13-18(14-12-17)35(32,33)28-19(9-5-2-6-10-21(29)27-31)22(30)26-23-25-20(15-34-23)16-7-3-1-4-8-16/h1,3-4,7-8,11-15,19,28,31H,2,5-6,9-10H2,(H,27,29)(H,25,26,30)/t19-/m0/s1