CID 72156

Tizolemide

Structural Information

Molecular Formula
C11H14ClN3O3S2
SMILES
CN=C1N(C(CS1)(C2=CC(=C(C=C2)Cl)S(=O)(=O)N)O)C
InChI
InChI=1S/C11H14ClN3O3S2/c1-14-10-15(2)11(16,6-19-10)7-3-4-8(12)9(5-7)20(13,17)18/h3-5,16H,6H2,1-2H3,(H2,13,17,18)
InChIKey
VYBZOPZNLLIEFX-UHFFFAOYSA-N
Compound name
2-chloro-5-(4-hydroxy-3-methyl-2-methylimino-1,3-thiazolidin-4-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

9
References

65
Patents

335.0165 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.023776 170.4
[M+Na]+ 358.005718 179.9
[M-H]- 334.009224 175.6
[M+NH4]+ 353.050323 187.5
[M+K]+ 373.979658 173.6
[M+H-H2O]+ 318.013760 166.1
[M+HCOO]- 380.014701 177.8
[M+CH3COO]- 394.030351 205.3
[M+Na-2H]- 355.991166 171.5
[M]+ 335.01595142 173.0
[M]- 335.01704858 173.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe