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]+ 371.117226 185.3
[M+Na]+ 393.099168 192.3
[M-H]- 369.102674 193.1
[M+NH4]+ 388.143773 196.0
[M+K]+ 409.073108 186.8
[M+H-H2O]+ 353.107210 175.9
[M+HCOO]- 415.108151 203.5
[M+CH3COO]- 429.123801 215.6
[M+Na-2H]- 391.084616 188.6
[M]+ 370.10940142 187.6
[M]- 370.11049858 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.