CID 135511233

Imidazo[2,1-b]thiazole-3-acetic acid, 6-phenyl-, 2-[(1e)-(5-bromo-2-hydroxyphenyl)methylidene]hydrazide

Structural Information

Molecular Formula
C20H15BrN4O2S
SMILES
C1=CC=C(C=C1)C2=CN3C(=CSC3=N2)CC(=O)N/N=C/C4=C(C=CC(=C4)Br)O
InChI
InChI=1S/C20H15BrN4O2S/c21-15-6-7-18(26)14(8-15)10-22-24-19(27)9-16-12-28-20-23-17(11-25(16)20)13-4-2-1-3-5-13/h1-8,10-12,26H,9H2,(H,24,27)/b22-10+
InChIKey
RNPRSKGQGVXHDW-LSHDLFTRSA-N
Compound name
N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-2-(6-phenylimidazo[2,1-b][1,3]thiazol-3-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

454.00992 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 455.01720 189.8
[M+Na]+ 476.99914 202.4
[M-H]- 453.00264 201.9
[M+NH4]+ 472.04374 204.9
[M+K]+ 492.97308 189.0
[M+H-H2O]+ 437.00718 188.1
[M+HCOO]- 499.00812 208.7
[M+CH3COO]- 513.02377 202.5
[M+Na-2H]- 474.98459 192.6
[M]+ 454.00937 213.1
[M]- 454.01047 213.1
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.