CID 9862076

Cyazofamid

Structural Information

Molecular Formula
C13H13ClN4O2S
SMILES
CC1=CC=C(C=C1)C2=C(N=C(N2S(=O)(=O)N(C)C)C#N)Cl
InChI
InChI=1S/C13H13ClN4O2S/c1-9-4-6-10(7-5-9)12-13(14)16-11(8-15)18(12)21(19,20)17(2)3/h4-7H,1-3H3
InChIKey
YXKMMRDKEKCERS-UHFFFAOYSA-N
Compound name
4-chloro-2-cyano-N,N-dimethyl-5-(4-methylphenyl)imidazole-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

29
References

27402
Patents

324.04477 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.05205 166.8
[M+Na]+ 347.03399 178.7
[M+NH4]+ 342.07859 170.2
[M+K]+ 363.00793 170.3
[M-H]- 323.03749 161.6
[M+Na-2H]- 345.01944 170.4
[M]+ 324.04422 166.8
[M]- 324.04532 166.8
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