CID 998021

313254-51-2

Structural Information

Molecular Formula
C23H19N3O3S2
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CS4
InChI
InChI=1S/C23H19N3O3S2/c27-22(21(17-7-3-1-4-8-17)18-9-5-2-6-10-18)25-19-11-13-20(14-12-19)31(28,29)26-23-24-15-16-30-23/h1-16,21H,(H,24,26)(H,25,27)
InChIKey
URSQNPPONHUJDL-UHFFFAOYSA-N
Compound name
2,2-diphenyl-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

10
References

2
Patents

449.0868 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 450.09408 203.1
[M+Na]+ 472.07602 208.5
[M-H]- 448.07952 213.8
[M+NH4]+ 467.12062 211.4
[M+K]+ 488.04996 201.3
[M+H-H2O]+ 432.08406 194.2
[M+HCOO]- 494.08500 216.2
[M+CH3COO]- 508.10065 211.1
[M+Na-2H]- 470.06147 205.7
[M]+ 449.08625 204.1
[M]- 449.08735 204.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe