CID 477908

2-(4-chlorophenyl)-3-{[4-(4-methoxybenzoylamino)benzoyl]amino}-4-thiazolidone

Structural Information

Molecular Formula
C24H20ClN3O4S
SMILES
COC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NN3C(SCC3=O)C4=CC=C(C=C4)Cl
InChI
InChI=1S/C24H20ClN3O4S/c1-32-20-12-6-15(7-13-20)22(30)26-19-10-4-16(5-11-19)23(31)27-28-21(29)14-33-24(28)17-2-8-18(25)9-3-17/h2-13,24H,14H2,1H3,(H,26,30)(H,27,31)
InChIKey
BBUVFIGPJYWHHJ-UHFFFAOYSA-N
Compound name
N-[2-(4-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-4-[(4-methoxybenzoyl)amino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

481.0863 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 482.09358 212.3
[M+Na]+ 504.07552 218.1
[M-H]- 480.07902 223.9
[M+NH4]+ 499.12012 220.5
[M+K]+ 520.04946 211.7
[M+H-H2O]+ 464.08356 203.0
[M+HCOO]- 526.08450 224.5
[M+CH3COO]- 540.10015 236.5
[M+Na-2H]- 502.06097 209.3
[M]+ 481.08575 215.9
[M]- 481.08685 215.9
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.