CID 1207354

174503-70-9

Structural Information

Molecular Formula
C18H12Cl2N2OS
SMILES
CSC1=NC2=CC(=C(C=C2N1)Cl)OC3=CC=C(C4=CC=CC=C43)Cl
InChI
InChI=1S/C18H12Cl2N2OS/c1-24-18-21-14-8-13(20)17(9-15(14)22-18)23-16-7-6-12(19)10-4-2-3-5-11(10)16/h2-9H,1H3,(H,21,22)
InChIKey
OSDDXEWTQZXREV-UHFFFAOYSA-N
Compound name
6-chloro-5-(4-chloronaphthalen-1-yl)oxy-2-methylsulfanyl-1H-benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

374.00473 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 375.01201 183.5
[M+Na]+ 396.99395 202.7
[M+NH4]+ 392.03855 193.8
[M+K]+ 412.96789 191.3
[M-H]- 372.99745 188.8
[M+Na-2H]- 394.97940 191.8
[M]+ 374.00418 189.2
[M]- 374.00528 189.2
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.