CID 3048929

Imidazo(2,1-b)thiazole-2-carboxamide, 3-methyl-n-(alpha,alpha,alpha-trifluoro-m-tolyl)-, hydrochloride

Structural Information

Molecular Formula
C14H12F3N3OS
SMILES
CC1=C(SC2=NCCN12)C(=O)NC3=CC=CC(=C3)C(F)(F)F
InChI
InChI=1S/C14H12F3N3OS/c1-8-11(22-13-18-5-6-20(8)13)12(21)19-10-4-2-3-9(7-10)14(15,16)17/h2-4,7H,5-6H2,1H3,(H,19,21)
InChIKey
JNUQMNICMGFXDC-UHFFFAOYSA-N
Compound name
3-methyl-N-[3-(trifluoromethyl)phenyl]-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

2
Patents

327.0653 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.07258 171.1
[M+Na]+ 350.05452 178.1
[M+NH4]+ 345.09912 176.3
[M+K]+ 366.02846 175.1
[M-H]- 326.05802 168.8
[M+Na-2H]- 348.03997 173.5
[M]+ 327.06475 171.4
[M]- 327.06585 171.4
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

patents stripe