CID 149569

Methanesulfonanilide, 3'-methoxy-4'-(4-(methylcarbamoylmethoxy)-9-acridinylamino)-, hydrochloride

Structural Information

Molecular Formula
C24H24N4O5S
SMILES
CNC(=O)COC1=CC=CC2=C(C3=CC=CC=C3N=C21)NC4=C(C=C(C=C4)NS(=O)(=O)C)OC
InChI
InChI=1S/C24H24N4O5S/c1-25-22(29)14-33-20-10-6-8-17-23(16-7-4-5-9-18(16)26-24(17)20)27-19-12-11-15(13-21(19)32-2)28-34(3,30)31/h4-13,28H,14H2,1-3H3,(H,25,29)(H,26,27)
InChIKey
ZIKCBROVQCAHDF-UHFFFAOYSA-N
Compound name
2-[9-[4-(methanesulfonamido)-2-methoxyanilino]acridin-4-yl]oxy-N-methylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

480.14673 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 481.15401 209.9
[M+Na]+ 503.13595 216.6
[M-H]- 479.13945 216.7
[M+NH4]+ 498.18055 217.2
[M+K]+ 519.10989 211.9
[M+H-H2O]+ 463.14399 199.5
[M+HCOO]- 525.14493 226.6
[M+CH3COO]- 539.16058 243.9
[M+Na-2H]- 501.12140 217.8
[M]+ 480.14618 217.3
[M]- 480.14728 217.3
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.