CID 581705

174503-48-1

Structural Information

Molecular Formula
C18H13ClN2OS
SMILES
CSC1=NC2=CC(=C(C=C2N1)Cl)OC3=CC4=CC=CC=C4C=C3
InChI
InChI=1S/C18H13ClN2OS/c1-23-18-20-15-9-14(19)17(10-16(15)21-18)22-13-7-6-11-4-2-3-5-12(11)8-13/h2-10H,1H3,(H,20,21)
InChIKey
CXAMQNQDJFZVFJ-UHFFFAOYSA-N
Compound name
6-chloro-2-methylsulfanyl-5-naphthalen-2-yloxy-1H-benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

340.0437 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.05098 175.6
[M+Na]+ 363.03292 194.1
[M+NH4]+ 358.07752 185.9
[M+K]+ 379.00686 183.3
[M-H]- 339.03642 181.1
[M+Na-2H]- 361.01837 184.4
[M]+ 340.04315 180.9
[M]- 340.04425 180.9
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.