CID 158673

Benzenesulfonamide, 2-(5-amino-1,3,4-thiadiazol-2-yl)-n-methyl-

Structural Information

Molecular Formula
C9H10N4O2S2
SMILES
CNS(=O)(=O)C1=CC=CC=C1C2=NN=C(S2)N
InChI
InChI=1S/C9H10N4O2S2/c1-11-17(14,15)7-5-3-2-4-6(7)8-12-13-9(10)16-8/h2-5,11H,1H3,(H2,10,13)
InChIKey
WOXJMDSFCKRTEO-UHFFFAOYSA-N
Compound name
2-(5-amino-1,3,4-thiadiazol-2-yl)-N-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

270.0245 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.031776 156.3
[M+Na]+ 293.013718 166.5
[M-H]- 269.017224 160.7
[M+NH4]+ 288.058323 171.9
[M+K]+ 308.987658 160.7
[M+H-H2O]+ 253.021760 149.3
[M+HCOO]- 315.022701 170.4
[M+CH3COO]- 329.038351 195.2
[M+Na-2H]- 290.999166 159.1
[M]+ 270.02395142 157.7
[M]- 270.02504858 157.7
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.