CID 24212738

3-bromo-n-(2-chlorophenyl)-1-benzothiophene-2-carboxamide

Structural Information

Molecular Formula
C15H9BrClNOS
SMILES
C1=CC=C2C(=C1)C(=C(S2)C(=O)NC3=CC=CC=C3Cl)Br
InChI
InChI=1S/C15H9BrClNOS/c16-13-9-5-1-4-8-12(9)20-14(13)15(19)18-11-7-3-2-6-10(11)17/h1-8H,(H,18,19)
InChIKey
FRVIPVDWVGNNDL-UHFFFAOYSA-N
Compound name
3-bromo-N-(2-chlorophenyl)-1-benzothiophene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

364.92767 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.93495 162.0
[M+Na]+ 387.91689 168.1
[M+NH4]+ 382.96149 168.6
[M+K]+ 403.89083 165.6
[M-H]- 363.92039 166.0
[M+Na-2H]- 385.90234 168.0
[M]+ 364.92712 163.7
[M]- 364.92822 163.7
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.