CID 25256866

N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]pyridine-3-carboxamide

Structural Information

Molecular Formula
C16H15N3O3S
SMILES
COC1=CC=C(C=C1)C2N(C(=O)CS2)NC(=O)C3=CN=CC=C3
InChI
InChI=1S/C16H15N3O3S/c1-22-13-6-4-11(5-7-13)16-19(14(20)10-23-16)18-15(21)12-3-2-8-17-9-12/h2-9,16H,10H2,1H3,(H,18,21)
InChIKey
FHEKGARVWDHLFR-UHFFFAOYSA-N
Compound name
N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]pyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

329.0834 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.09068 174.4
[M+Na]+ 352.07262 181.7
[M-H]- 328.07612 182.0
[M+NH4]+ 347.11722 187.4
[M+K]+ 368.04656 177.1
[M+H-H2O]+ 312.08066 165.4
[M+HCOO]- 374.08160 191.0
[M+CH3COO]- 388.09725 206.7
[M+Na-2H]- 350.05807 174.2
[M]+ 329.08285 175.7
[M]- 329.08395 175.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.