CID 6435199

3-(2-methoxyphenyl)-5-((4-methylphenyl)methylene)-2-thioxo-4-imidazolidinone

Structural Information

Molecular Formula
C18H16N2O2S
SMILES
CC1=CC=C(C=C1)/C=C\2/C(=O)N(C(=S)N2)C3=CC=CC=C3OC
InChI
InChI=1S/C18H16N2O2S/c1-12-7-9-13(10-8-12)11-14-17(21)20(18(23)19-14)15-5-3-4-6-16(15)22-2/h3-11H,1-2H3,(H,19,23)/b14-11-
InChIKey
KGXVSULVNFXLNJ-KAMYIIQDSA-N
Compound name
(5Z)-3-(2-methoxyphenyl)-5-[(4-methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

324.09326 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.10054 177.6
[M+Na]+ 347.08248 191.4
[M+NH4]+ 342.12708 184.7
[M+K]+ 363.05642 183.4
[M-H]- 323.08598 181.7
[M+Na-2H]- 345.06793 184.1
[M]+ 324.09271 181.1
[M]- 324.09381 181.1
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.