CID 469779

3-(1-naphthylsulfonyl)-2-(3-pyridyl)thiazolidine

Structural Information

Molecular Formula
C18H16N2O2S2
SMILES
C1CSC(N1S(=O)(=O)C2=CC=CC3=CC=CC=C32)C4=CN=CC=C4
InChI
InChI=1S/C18H16N2O2S2/c21-24(22,17-9-3-6-14-5-1-2-8-16(14)17)20-11-12-23-18(20)15-7-4-10-19-13-15/h1-10,13,18H,11-12H2
InChIKey
FMGIAKISEDLATJ-UHFFFAOYSA-N
Compound name
3-naphthalen-1-ylsulfonyl-2-pyridin-3-yl-1,3-thiazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

356.0653 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.07258 181.0
[M+Na]+ 379.05452 190.4
[M-H]- 355.05802 188.8
[M+NH4]+ 374.09912 194.6
[M+K]+ 395.02846 183.6
[M+H-H2O]+ 339.06256 173.6
[M+HCOO]- 401.06350 190.3
[M+CH3COO]- 415.07915 191.1
[M+Na-2H]- 377.03997 183.1
[M]+ 356.06475 182.1
[M]- 356.06585 182.1
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.