CID 3054829

71795-44-3

Structural Information

Molecular Formula
C18H18N4O3S
SMILES
CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CN2CC3=CC=CC=C3
InChI
InChI=1S/C18H18N4O3S/c1-14(23)20-16-7-9-17(10-8-16)26(24,25)21-18-19-11-12-22(18)13-15-5-3-2-4-6-15/h2-12H,13H2,1H3,(H,19,21)(H,20,23)
InChIKey
GLPZJSPKYUVIPF-UHFFFAOYSA-N
Compound name
N-[4-[(1-benzylimidazol-2-yl)sulfamoyl]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

370.10995 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.11723 185.3
[M+Na]+ 393.09917 192.3
[M-H]- 369.10267 193.1
[M+NH4]+ 388.14377 196.0
[M+K]+ 409.07311 186.8
[M+H-H2O]+ 353.10721 175.9
[M+HCOO]- 415.10815 203.5
[M+CH3COO]- 429.12380 215.6
[M+Na-2H]- 391.08462 188.6
[M]+ 370.10940 187.6
[M]- 370.11050 187.6
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.