CID 3062885

3-(4,5-dihydro-1h-imidazol-2-yl)-5-((dimethylamino)methyl)-2-thioxo-4-thiazolidinone hi

Structural Information

Molecular Formula
C9H14N4OS2
SMILES
CN(C)CC1C(=O)N(C(=S)S1)C2=NCCN2
InChI
InChI=1S/C9H14N4OS2/c1-12(2)5-6-7(14)13(9(15)16-6)8-10-3-4-11-8/h6H,3-5H2,1-2H3,(H,10,11)
InChIKey
MLNXHYUNNIPIBF-UHFFFAOYSA-N
Compound name
3-(4,5-dihydro-1H-imidazol-2-yl)-5-[(dimethylamino)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.0609 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.06818 158.3
[M+Na]+ 281.05012 165.7
[M+NH4]+ 276.09472 165.2
[M+K]+ 297.02406 161.1
[M-H]- 257.05362 159.2
[M+Na-2H]- 279.03557 159.7
[M]+ 258.06035 160.0
[M]- 258.06145 160.0
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.