CID 3048916

Imidazo(2,1-b)thiazole-2-carboxamide, 5,6-dihydro-n-mesityl-3-phenyl-, hydrochloride

Structural Information

Molecular Formula
C21H21N3OS
SMILES
CC1=CC(=C(C(=C1)C)NC(=O)C2=C(N3CCN=C3S2)C4=CC=CC=C4)C
InChI
InChI=1S/C21H21N3OS/c1-13-11-14(2)17(15(3)12-13)23-20(25)19-18(16-7-5-4-6-8-16)24-10-9-22-21(24)26-19/h4-8,11-12H,9-10H2,1-3H3,(H,23,25)
InChIKey
GNTQUXIOZNMQSA-UHFFFAOYSA-N
Compound name
3-phenyl-N-(2,4,6-trimethylphenyl)-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

363.14053 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.14781 186.6
[M+Na]+ 386.12975 200.0
[M+NH4]+ 381.17435 195.1
[M+K]+ 402.10369 193.7
[M-H]- 362.13325 192.7
[M+Na-2H]- 384.11520 193.7
[M]+ 363.13998 190.7
[M]- 363.14108 190.7
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