CID 342762

21578-56-3

Structural Information

Molecular Formula
C15H11N5O3S2
SMILES
C1=CC=C2C(=C1)N=C3N2C(=O)C(S3)N=NC4=CC=C(C=C4)S(=O)(=O)N
InChI
InChI=1S/C15H11N5O3S2/c16-25(22,23)10-7-5-9(6-8-10)18-19-13-14(21)20-12-4-2-1-3-11(12)17-15(20)24-13/h1-8,13H,(H2,16,22,23)
InChIKey
GWESPXKLHYXRDQ-UHFFFAOYSA-N
Compound name
4-[(1-oxo-[1,3]thiazolo[3,2-a]benzimidazol-2-yl)diazenyl]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

373.03033 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.03761 182.6
[M+Na]+ 396.01955 194.9
[M-H]- 372.02305 192.1
[M+NH4]+ 391.06415 199.2
[M+K]+ 411.99349 189.7
[M+H-H2O]+ 356.02759 176.7
[M+HCOO]- 418.02853 200.1
[M+CH3COO]- 432.04418 194.6
[M+Na-2H]- 394.00500 188.2
[M]+ 373.02978 189.5
[M]- 373.03088 189.5
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

No patent data available for this compound.