CID 6481338

N-(3-methoxyphenyl)-4-[4-[(3-methoxyphenyl)sulfamoyl]phenoxy]benzenesulfonamide

Structural Information

Molecular Formula
C26H24N2O7S2
SMILES
COC1=CC=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)S(=O)(=O)NC4=CC(=CC=C4)OC
InChI
InChI=1S/C26H24N2O7S2/c1-33-23-7-3-5-19(17-23)27-36(29,30)25-13-9-21(10-14-25)35-22-11-15-26(16-12-22)37(31,32)28-20-6-4-8-24(18-20)34-2/h3-18,27-28H,1-2H3
InChIKey
HTAHJRYZQGHPCW-UHFFFAOYSA-N
Compound name
N-(3-methoxyphenyl)-4-[4-[(3-methoxyphenyl)sulfamoyl]phenoxy]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

540.1025 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 541.10978 224.7
[M+Na]+ 563.09172 229.5
[M-H]- 539.09522 235.8
[M+NH4]+ 558.13632 228.2
[M+K]+ 579.06566 224.0
[M+H-H2O]+ 523.09976 213.4
[M+HCOO]- 585.10070 237.7
[M+CH3COO]- 599.11635 244.8
[M+Na-2H]- 561.07717 231.0
[M]+ 540.10195 230.6
[M]- 540.10305 230.6
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.