CID 497218

2-(2,6-dichlorophenyl)-3-(4-methyl-2-pyridyl)thiazolidine-4-thione

Structural Information

Molecular Formula
C15H12Cl2N2S2
SMILES
CC1=CC(=NC=C1)N2C(SCC2=S)C3=C(C=CC=C3Cl)Cl
InChI
InChI=1S/C15H12Cl2N2S2/c1-9-5-6-18-12(7-9)19-13(20)8-21-15(19)14-10(16)3-2-4-11(14)17/h2-7,15H,8H2,1H3
InChIKey
DHNDRJAWJGBMLR-UHFFFAOYSA-N
Compound name
2-(2,6-dichlorophenyl)-3-(4-methylpyridin-2-yl)-1,3-thiazolidine-4-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

353.9819 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.98918 175.1
[M+Na]+ 376.97112 187.0
[M-H]- 352.97462 182.4
[M+NH4]+ 372.01572 190.1
[M+K]+ 392.94506 178.3
[M+H-H2O]+ 336.97916 169.0
[M+HCOO]- 398.98010 176.3
[M+CH3COO]- 412.99575 185.8
[M+Na-2H]- 374.95657 170.6
[M]+ 353.98135 178.5
[M]- 353.98245 178.5
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.