CID 3054823

71795-38-5

Structural Information

Molecular Formula
C15H16N4O3S
SMILES
CC1=CN=C(N1CC#C)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C
InChI
InChI=1S/C15H16N4O3S/c1-4-9-19-11(2)10-16-15(19)18-23(21,22)14-7-5-13(6-8-14)17-12(3)20/h1,5-8,10H,9H2,2-3H3,(H,16,18)(H,17,20)
InChIKey
RZBRNAZPFUFHME-UHFFFAOYSA-N
Compound name
N-[4-[(5-methyl-1-prop-2-ynylimidazol-2-yl)sulfamoyl]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

332.0943 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.10158 172.7
[M+Na]+ 355.08352 181.9
[M+NH4]+ 350.12812 174.2
[M+K]+ 371.05746 174.6
[M-H]- 331.08702 165.7
[M+Na-2H]- 353.06897 174.5
[M]+ 332.09375 171.3
[M]- 332.09485 171.3
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.