CID 721139

104246-27-7

Structural Information

Molecular Formula
C11H10ClN3O3S2
SMILES
C1=CC(=CC=C1NC(=O)CCl)S(=O)(=O)NC2=NC=CS2
InChI
InChI=1S/C11H10ClN3O3S2/c12-7-10(16)14-8-1-3-9(4-2-8)20(17,18)15-11-13-5-6-19-11/h1-6H,7H2,(H,13,15)(H,14,16)
InChIKey
NSUHLTKMBRDPDN-UHFFFAOYSA-N
Compound name
2-chloro-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

25
Patents

330.9852 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.99248 170.7
[M+Na]+ 353.97442 179.2
[M-H]- 329.97792 176.5
[M+NH4]+ 349.01902 185.8
[M+K]+ 369.94836 172.8
[M+H-H2O]+ 313.98246 164.6
[M+HCOO]- 375.98340 180.9
[M+CH3COO]- 389.99905 202.8
[M+Na-2H]- 351.95987 173.3
[M]+ 330.98465 174.9
[M]- 330.98575 174.9
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