CID 15956001

5-(3,5-difluorophenyl)-2-hydroxy-n-[4-oxo-2-(p-tolyl)thiazolidin-3-yl]benzamide

Structural Information

Molecular Formula
C23H18F2N2O3S
SMILES
CC1=CC=C(C=C1)C2N(C(=O)CS2)NC(=O)C3=C(C=CC(=C3)C4=CC(=CC(=C4)F)F)O
InChI
InChI=1S/C23H18F2N2O3S/c1-13-2-4-14(5-3-13)23-27(21(29)12-31-23)26-22(30)19-10-15(6-7-20(19)28)16-8-17(24)11-18(25)9-16/h2-11,23,28H,12H2,1H3,(H,26,30)
InChIKey
RFFBASXIYABSLS-UHFFFAOYSA-N
Compound name
5-(3,5-difluorophenyl)-2-hydroxy-N-[2-(4-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

440.10062 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 441.10790 202.0
[M+Na]+ 463.08984 210.3
[M-H]- 439.09334 210.4
[M+NH4]+ 458.13444 211.3
[M+K]+ 479.06378 202.6
[M+H-H2O]+ 423.09788 191.2
[M+HCOO]- 485.09882 215.0
[M+CH3COO]- 499.11447 210.4
[M+Na-2H]- 461.07529 196.6
[M]+ 440.10007 200.6
[M]- 440.10117 200.6
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.