CID 4123591

93501-51-0

Structural Information

Molecular Formula
C14H10F3N3O2S
SMILES
C1CSC2=NC=C(C(=O)N21)C(=O)NC3=CC=CC(=C3)C(F)(F)F
InChI
InChI=1S/C14H10F3N3O2S/c15-14(16,17)8-2-1-3-9(6-8)19-11(21)10-7-18-13-20(12(10)22)4-5-23-13/h1-3,6-7H,4-5H2,(H,19,21)
InChIKey
CPMZWDDDPRCVHU-UHFFFAOYSA-N
Compound name
5-oxo-N-[3-(trifluoromethyl)phenyl]-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

0
Patents

341.0446 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.05188 171.3
[M+Na]+ 364.03382 179.6
[M+NH4]+ 359.07842 175.9
[M+K]+ 380.00776 174.9
[M-H]- 340.03732 169.1
[M+Na-2H]- 362.01927 174.9
[M]+ 341.04405 171.9
[M]- 341.04515 171.9
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.