CID 3480881

2-chloro-n-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-phenylacetamide

Structural Information

Molecular Formula
C18H15ClN2OS
SMILES
CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C(C3=CC=CC=C3)Cl
InChI
InChI=1S/C18H15ClN2OS/c1-12-7-9-13(10-8-12)15-11-23-18(20-15)21-17(22)16(19)14-5-3-2-4-6-14/h2-11,16H,1H3,(H,20,21,22)
InChIKey
BWRYNRGNDMHXKK-UHFFFAOYSA-N
Compound name
2-chloro-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

342.05936 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.06664 178.5
[M+Na]+ 365.04858 186.6
[M-H]- 341.05208 187.5
[M+NH4]+ 360.09318 193.3
[M+K]+ 381.02252 179.8
[M+H-H2O]+ 325.05662 170.7
[M+HCOO]- 387.05756 192.3
[M+CH3COO]- 401.07321 189.5
[M+Na-2H]- 363.03403 178.0
[M]+ 342.05881 182.0
[M]- 342.05991 182.0
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.