CID 985941

N-{4-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl}-2-[4-(propan-2-yl)phenoxy]acetamide

Structural Information

Molecular Formula
C22H25N3O5S
SMILES
CC1=C(ON=C1C)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)COC3=CC=C(C=C3)C(C)C
InChI
InChI=1S/C22H25N3O5S/c1-14(2)17-5-9-19(10-6-17)29-13-21(26)23-18-7-11-20(12-8-18)31(27,28)25-22-15(3)16(4)24-30-22/h5-12,14,25H,13H2,1-4H3,(H,23,26)
InChIKey
LMSAMDYKTGGOBM-UHFFFAOYSA-N
Compound name
N-[4-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl]-2-(4-propan-2-ylphenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

443.1515 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 444.15878 206.3
[M+Na]+ 466.14072 212.2
[M-H]- 442.14422 216.1
[M+NH4]+ 461.18532 214.3
[M+K]+ 482.11466 209.4
[M+H-H2O]+ 426.14876 197.3
[M+HCOO]- 488.14970 222.9
[M+CH3COO]- 502.16535 232.8
[M+Na-2H]- 464.12617 206.3
[M]+ 443.15095 212.9
[M]- 443.15205 212.9
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.