CID 3054934
1-(beta-((5'-chlorpyridyl-2'-thio-2-aethylthio)-2,4-dichlorphenaethyl))-imidazol [german]
Structural Information
- Molecular Formula
- C18H16Cl3N3S2
- SMILES
- C1=CC(=C(C=C1Cl)Cl)C(CN2C=CN=C2)SCCSC3=NC=C(C=C3)Cl
- InChI
- InChI=1S/C18H16Cl3N3S2/c19-13-1-3-15(16(21)9-13)17(11-24-6-5-22-12-24)25-7-8-26-18-4-2-14(20)10-23-18/h1-6,9-10,12,17H,7-8,11H2
- InChIKey
- CFEUYKKOHADPCZ-UHFFFAOYSA-N
- Compound name
- 5-chloro-2-[2-[1-(2,4-dichlorophenyl)-2-imidazol-1-ylethyl]sulfanylethylsulfanyl]pyridine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 443.99242 | 189.7 |
[M+Na]+ | 465.97436 | 199.5 |
[M-H]- | 441.97786 | 194.2 |
[M+NH4]+ | 461.01896 | 199.6 |
[M+K]+ | 481.94830 | 190.9 |
[M+H-H2O]+ | 425.98240 | 182.1 |
[M+HCOO]- | 487.98334 | 185.2 |
[M+CH3COO]- | 501.99899 | 197.7 |
[M+Na-2H]- | 463.95981 | 185.6 |
[M]+ | 442.98459 | 196.2 |
[M]- | 442.98569 | 196.2 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.