CID 1899362

7-methyl-2-(4-morpholinyl)-3-[(z)-(4-oxo-3-propyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4h-pyrido[1,2-a]pyrimidin-4-one

Structural Information

Molecular Formula
C20H22N4O3S2
SMILES
CCCN1C(=O)/C(=C/C2=C(N=C3C=CC(=CN3C2=O)C)N4CCOCC4)/SC1=S
InChI
InChI=1S/C20H22N4O3S2/c1-3-6-23-19(26)15(29-20(23)28)11-14-17(22-7-9-27-10-8-22)21-16-5-4-13(2)12-24(16)18(14)25/h4-5,11-12H,3,6-10H2,1-2H3/b15-11-
InChIKey
HQYYKAUGWJCLAJ-PTNGSMBKSA-N
Compound name
(5Z)-5-[(7-methyl-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-3-yl)methylidene]-3-propyl-2-sulfanylidene-1,3-thiazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

430.11334 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 431.12062 201.1
[M+Na]+ 453.10256 213.7
[M+NH4]+ 448.14716 206.9
[M+K]+ 469.07650 204.9
[M-H]- 429.10606 205.4
[M+Na-2H]- 451.08801 203.4
[M]+ 430.11279 204.9
[M]- 430.11389 204.9
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.