CID 129626311

4-thiazolidinone, 5-((4-hydroxy-3-methoxyphenyl)methylene)-3-(((2-methoxyphenyl)amino)methyl)-2-thioxo-

Structural Information

Molecular Formula
C19H18N2O4S2
SMILES
COC1=CC=CC=C1NCN2C(=O)/C(=C\C3=CC(=C(C=C3)O)OC)/SC2=S
InChI
InChI=1S/C19H18N2O4S2/c1-24-15-6-4-3-5-13(15)20-11-21-18(23)17(27-19(21)26)10-12-7-8-14(22)16(9-12)25-2/h3-10,20,22H,11H2,1-2H3/b17-10+
InChIKey
HOXYPJPPNQPPBT-LICLKQGHSA-N
Compound name
(5E)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-3-[(2-methoxyanilino)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

402.0708 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 403.07808 192.7
[M+Na]+ 425.06002 203.5
[M+NH4]+ 420.10462 198.9
[M+K]+ 441.03396 195.0
[M-H]- 401.06352 196.8
[M+Na-2H]- 423.04547 197.5
[M]+ 402.07025 196.1
[M]- 402.07135 196.1
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.