CID 6448313

1-(2'-methyl-6'-methoxyquinolin-4'-ylamino)-2-methyl-4-benzylideneimidazolin-5-one

Structural Information

Molecular Formula
C22H20N4O2
SMILES
CC1=CC(=C2C=C(C=CC2=N1)OC)NN3C(=N/C(=C\C4=CC=CC=C4)/C3=O)C
InChI
InChI=1S/C22H20N4O2/c1-14-11-20(18-13-17(28-3)9-10-19(18)23-14)25-26-15(2)24-21(22(26)27)12-16-7-5-4-6-8-16/h4-13H,1-3H3,(H,23,25)/b21-12-
InChIKey
CGEIDQZIEMTHKU-MTJSOVHGSA-N
Compound name
(5Z)-5-benzylidene-3-[(6-methoxy-2-methylquinolin-4-yl)amino]-2-methylimidazol-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

372.15863 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.16591 192.0
[M+Na]+ 395.14785 207.6
[M+NH4]+ 390.19245 198.7
[M+K]+ 411.12179 200.8
[M-H]- 371.15135 197.4
[M+Na-2H]- 393.13330 200.0
[M]+ 372.15808 195.7
[M]- 372.15918 195.7
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.