CID 149297

66147-74-8

Structural Information

Molecular Formula
C22H22N4O3S
SMILES
CNC1=CC2=NC3=CC=CC=C3C(=C2C=C1)NC4=C(C=C(C=C4)NS(=O)(=O)C)OC
InChI
InChI=1S/C22H22N4O3S/c1-23-14-8-10-17-20(12-14)24-18-7-5-4-6-16(18)22(17)25-19-11-9-15(13-21(19)29-2)26-30(3,27)28/h4-13,23,26H,1-3H3,(H,24,25)
InChIKey
CSRQEOZYFKMLKK-UHFFFAOYSA-N
Compound name
N-[3-methoxy-4-[[3-(methylamino)acridin-9-yl]amino]phenyl]methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

422.14127 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 423.14855 197.8
[M+Na]+ 445.13049 212.2
[M+NH4]+ 440.17509 205.0
[M+K]+ 461.10443 202.3
[M-H]- 421.13399 203.9
[M+Na-2H]- 443.11594 206.7
[M]+ 422.14072 202.2
[M]- 422.14182 202.2
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

No patent data available for this compound.