CAS Registry Number: 135773-25-0

Name:

1H-​Imidazole-​1-​sulfonamide, 4-​iodo-​N,​N-​dimethyl-
1-​(Dimethylsulfamoyl)​-​4-​iodoimidazole; 4-​Iodo-​N,​N-​dimethyl-​1H-​imidazole-​1-​sulfonamide 

Chemical Formula: C5H8IN3O2S
Exact Mass: 300.94
Molecular Weight: 301.11
m/z: 300.94 (100.0%), 301.94 (7.5%), 302.93 (4.5%)
Elemental Analysis: C, 19.94; H, 2.68; I, 42.15; N, 13.96; O, 10.63; S, 10.65

InChI: InChI=1S/C5H8IN3O2S/c1-8(2)12(10,11)9-3-5(6)7-4-9/h3-4H,1-2H3
InChIKey: HSJHNZMKMJPPGU-UHFFFAOYSA-N
Canonical SMILES : CN(C)S(=O)(=O)N1C=C(N=C1)I

Specification

98%

1. (1) WSS: Wolfgang Robien / University of Vienna (Spectral Data were obtained from Wiley Subscription Services, Inc. (US))
2. (2) Lovely, Carl J.; Journal of Organic Chemistry 2007, V72(10), P3741-3749 CAPLUS
3. (3) De Esch, Iwan J. P.; Journal of Medicinal Chemistry 1999, V42(7), P1115-1122 CAPLUS