CID 1908716

Salor-int l246298-1ea

Structural Information

Molecular Formula
C23H28N4O3S2
SMILES
CC1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)/C=C\4/C(=O)N(C(=S)S4)CCCOC
InChI
InChI=1S/C23H28N4O3S2/c1-15-7-11-25(12-8-15)20-17(21(28)26-9-4-6-16(2)19(26)24-20)14-18-22(29)27(23(31)32-18)10-5-13-30-3/h4,6,9,14-15H,5,7-8,10-13H2,1-3H3/b18-14-
InChIKey
ACCCDSZUAUEYJD-JXAWBTAJSA-N
Compound name
(5Z)-3-(3-methoxypropyl)-5-[[9-methyl-2-(4-methylpiperidin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

472.16028 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 473.16756 213.8
[M+Na]+ 495.14950 225.6
[M+NH4]+ 490.19410 219.1
[M+K]+ 511.12344 216.1
[M-H]- 471.15300 216.7
[M+Na-2H]- 493.13495 215.8
[M]+ 472.15973 217.0
[M]- 472.16083 217.0
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.