2-[[4-(4-bromanylphenoxy)phenyl]sulfonylamino]-3-methyl-3-(1-methylimidazol-2-yl)sulfanyl-N-oxidanyl-butanamide

Systemtic Name: 2-[[4-(4-bromanylphenoxy)phenyl]sulfonylamino]-3-methyl-3-(1-methylimidazol-2-yl)sulfanyl-N-oxidanyl-butanamide Openeye Name: 2-[[4-(4-bromophenoxy)phenyl]sulfonylamino]-3-methyl-3-(1-methylimidazol-2-yl)sulfanyl-butanehydroxamic acid CAS Name: 2-[[4-(4-bromophenoxy)phenyl]sulfonylamino]-N-hydroxy-3-methyl-3-[(1-methyl-2-imidazolyl)thio]butanamide IUPAC Name: 2-[[4-(4-bromophenoxy)phenyl]sulfonylamino]-N-hydroxy-3-methyl-3-(1-methylimidazol-2-yl)sulfanylbutanamide Traditional Name: 2-[[4-(4-bromophenoxy)phenyl]sulfonylamino]-3-methyl-3-[(1-methylimidazol-2-yl)thio]butanehydroxamic acid Formula: C21H23BrN4O5S2 MolecularWeight: 555.46512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C(=O)NO)NS(=O)(=O)C1=CC=C(C=C1)OC2=CC=C(C=C2)Br)SC3=NC=CN3C

Isomeric SMILES

CC(C)(C(C(=O)NO)NS(=O)(=O)C1=CC=C(C=C1)OC2=CC=C(C=C2)Br)SC3=NC=CN3C

InChI

InChI=1S/C21H23BrN4O5S2/c1-21(2,32-20-23-12-13-26(20)3)18(19(27)24-28)25-33(29,30)17-10-8-16(9-11-17)31-15-6-4-14(22)5-7-15/h4-13,18,25,28H,1-3H3,(H,24,27)