CID 472882

Fshg

Structural Information

Molecular Formula
C21H22N4O2S2
SMILES
C1CCC2(CC1)N(C(=O)CS2)NC(=O)CC3=CSC4=NC(=CN34)C5=CC=CC=C5
InChI
InChI=1S/C21H22N4O2S2/c26-18(23-25-19(27)14-29-21(25)9-5-2-6-10-21)11-16-13-28-20-22-17(12-24(16)20)15-7-3-1-4-8-15/h1,3-4,7-8,12-13H,2,5-6,9-11,14H2,(H,23,26)
InChIKey
USDKOJIZQBYIFT-UHFFFAOYSA-N
Compound name
N-(3-oxo-1-thia-4-azaspiro[4.5]decan-4-yl)-2-(6-phenylimidazo[2,1-b][1,3]thiazol-3-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3
Patents

426.1184 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 427.12568 196.2
[M+Na]+ 449.10762 205.1
[M-H]- 425.11112 205.9
[M+NH4]+ 444.15222 211.8
[M+K]+ 465.08156 199.8
[M+H-H2O]+ 409.11566 190.5
[M+HCOO]- 471.11660 205.8
[M+CH3COO]- 485.13225 205.5
[M+Na-2H]- 447.09307 192.7
[M]+ 426.11785 197.8
[M]- 426.11895 197.8
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

No patent data available for this compound.