CID 3021444

Methanesulfonamide, n-(4-(1h-benzimidazol-2-yl)-3-methoxyphenyl)-

Structural Information

Molecular Formula
C15H15N3O3S
SMILES
COC1=C(C=CC(=C1)NS(=O)(=O)C)C2=NC3=CC=CC=C3N2
InChI
InChI=1S/C15H15N3O3S/c1-21-14-9-10(18-22(2,19)20)7-8-11(14)15-16-12-5-3-4-6-13(12)17-15/h3-9,18H,1-2H3,(H,16,17)
InChIKey
FJEZIXJIUBQVQC-UHFFFAOYSA-N
Compound name
N-[4-(1H-benzimidazol-2-yl)-3-methoxyphenyl]methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

317.0834 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 318.09068 171.1
[M+Na]+ 340.07262 181.9
[M-H]- 316.07612 176.2
[M+NH4]+ 335.11722 185.6
[M+K]+ 356.04656 176.2
[M+H-H2O]+ 300.08066 163.8
[M+HCOO]- 362.08160 188.5
[M+CH3COO]- 376.09725 202.5
[M+Na-2H]- 338.05807 176.4
[M]+ 317.08285 175.9
[M]- 317.08395 175.9
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

patents stripe