CID 91103679

Dtxsid701028266

Structural Information

Molecular Formula
C10H12N4O5S2
SMILES
CCS(=O)(=O)C1=C(N2C=CC=CC2=N1)S(=O)(=O)NC(=O)N
InChI
InChI=1S/C10H12N4O5S2/c1-2-20(16,17)8-9(21(18,19)13-10(11)15)14-6-4-3-5-7(14)12-8/h3-6H,2H2,1H3,(H3,11,13,15)
InChIKey
XOHMJAPFRWCQMP-UHFFFAOYSA-N
Compound name
(2-ethylsulfonylimidazo[1,2-a]pyridin-3-yl)sulfonylurea
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

5
Patents

332.0249 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.03218 172.4
[M+Na]+ 355.01412 182.1
[M-H]- 331.01762 174.4
[M+NH4]+ 350.05872 186.0
[M+K]+ 370.98806 177.5
[M+H-H2O]+ 315.02216 166.5
[M+HCOO]- 377.02310 184.2
[M+CH3COO]- 391.03875 204.5
[M+Na-2H]- 352.99957 177.9
[M]+ 332.02435 177.6
[M]- 332.02545 177.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.