CID 3054820

71795-35-2

Structural Information

Molecular Formula
C16H23N5O3S
SMILES
CC1=CN=C(N1CCN(C)C)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C
InChI
InChI=1S/C16H23N5O3S/c1-12-11-17-16(21(12)10-9-20(3)4)19-25(23,24)15-7-5-14(6-8-15)18-13(2)22/h5-8,11H,9-10H2,1-4H3,(H,17,19)(H,18,22)
InChIKey
CCJJQMYSIBUXCB-UHFFFAOYSA-N
Compound name
N-[4-[[1-[2-(dimethylamino)ethyl]-5-methylimidazol-2-yl]sulfamoyl]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

365.15216 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.15944 185.0
[M+Na]+ 388.14138 192.6
[M+NH4]+ 383.18598 189.2
[M+K]+ 404.11532 189.2
[M-H]- 364.14488 186.6
[M+Na-2H]- 386.12683 189.5
[M]+ 365.15161 186.5
[M]- 365.15271 186.5
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.