CID 6435575

99541-67-0

Structural Information

Molecular Formula
C26H24N2O6S
SMILES
CC1(N(C(=O)/C(=C/C2=CC=CC=C2O)/S1)NC(=O)C3=CC=CC=C3O)C4=CC(=CC(=C4)OC)OC
InChI
InChI=1S/C26H24N2O6S/c1-26(17-13-18(33-2)15-19(14-17)34-3)28(27-24(31)20-9-5-7-11-22(20)30)25(32)23(35-26)12-16-8-4-6-10-21(16)29/h4-15,29-30H,1-3H3,(H,27,31)/b23-12-
InChIKey
DJZPWPCEUWEIMX-FMCGGJTJSA-N
Compound name
N-[(5Z)-2-(3,5-dimethoxyphenyl)-5-[(2-hydroxyphenyl)methylidene]-2-methyl-4-oxo-1,3-thiazolidin-3-yl]-2-hydroxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

492.1355 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 493.14278 216.2
[M+Na]+ 515.12472 227.8
[M+NH4]+ 510.16932 221.9
[M+K]+ 531.09866 220.0
[M-H]- 491.12822 221.2
[M+Na-2H]- 513.11017 224.1
[M]+ 492.13495 219.6
[M]- 492.13605 219.6
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.