CID 7181

Sulfaethidole

Structural Information

Molecular Formula
C10H12N4O2S2
SMILES
CCC1=NN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)N
InChI
InChI=1S/C10H12N4O2S2/c1-2-9-12-13-10(17-9)14-18(15,16)8-5-3-7(11)4-6-8/h3-6H,2,11H2,1H3,(H,13,14)
InChIKey
SVYBEBLNQGDRHF-UHFFFAOYSA-N
Compound name
4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

31
References

2722
Patents

284.04016 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.04744 160.4
[M+Na]+ 307.02938 169.9
[M+NH4]+ 302.07398 167.0
[M+K]+ 323.00332 163.5
[M-H]- 283.03288 162.6
[M+Na-2H]- 305.01483 165.8
[M]+ 284.03961 163.0
[M]- 284.04071 163.0
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