CID 3054838

71795-52-3

Structural Information

Molecular Formula
C16H16N4O2S
SMILES
C1=CC=C(C=C1)CN2C=CN=C2NS(=O)(=O)C3=CC=C(C=C3)N
InChI
InChI=1S/C16H16N4O2S/c17-14-6-8-15(9-7-14)23(21,22)19-16-18-10-11-20(16)12-13-4-2-1-3-5-13/h1-11H,12,17H2,(H,18,19)
InChIKey
IUFUHMBSVVFYSO-UHFFFAOYSA-N
Compound name
4-amino-N-(1-benzylimidazol-2-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

328.0994 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 329.10668 173.4
[M+Na]+ 351.08862 185.4
[M+NH4]+ 346.13322 180.0
[M+K]+ 367.06256 179.2
[M-H]- 327.09212 178.1
[M+Na-2H]- 349.07407 182.6
[M]+ 328.09885 176.7
[M]- 328.09995 176.7
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.