CID 3069613

84950-80-1

Structural Information

Molecular Formula
C13H11Cl2N3OS
SMILES
CC1=C(SC2=NCCN12)C(=O)NC3=CC(=C(C=C3)Cl)Cl
InChI
InChI=1S/C13H11Cl2N3OS/c1-7-11(20-13-16-4-5-18(7)13)12(19)17-8-2-3-9(14)10(15)6-8/h2-3,6H,4-5H2,1H3,(H,17,19)
InChIKey
BCKCHZCSPMOHMR-UHFFFAOYSA-N
Compound name
N-(3,4-dichlorophenyl)-3-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

327.0 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.00728 170.6
[M+Na]+ 349.98922 183.5
[M+NH4]+ 345.03382 179.4
[M+K]+ 365.96316 177.4
[M-H]- 325.99272 173.7
[M+Na-2H]- 347.97467 175.5
[M]+ 326.99945 174.2
[M]- 327.00055 174.2
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

patents stripe