CID 2329065

2-((3,4-dichlorophenyl)methylene)thiazolo(3,2-a)benzimidazol-3(2h)-one

Structural Information

Molecular Formula
C16H8Cl2N2OS
SMILES
C1=CC=C2C(=C1)N=C3N2C(=O)/C(=C\C4=CC(=C(C=C4)Cl)Cl)/S3
InChI
InChI=1S/C16H8Cl2N2OS/c17-10-6-5-9(7-11(10)18)8-14-15(21)20-13-4-2-1-3-12(13)19-16(20)22-14/h1-8H/b14-8+
InChIKey
ACVSJJYWYGXCEF-RIYZIHGNSA-N
Compound name
(2E)-2-[(3,4-dichlorophenyl)methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

345.97345 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 346.98073 175.3
[M+Na]+ 368.96267 194.4
[M+NH4]+ 364.00727 185.5
[M+K]+ 384.93661 185.0
[M-H]- 344.96617 180.0
[M+Na-2H]- 366.94812 183.3
[M]+ 345.97290 180.7
[M]- 345.97400 180.7
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.