CID 118572867

N-propyl-3-(pyridine-3-sulfonamido)benzamide

Structural Information

Molecular Formula
C15H17N3O3S
SMILES
CCCNC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=CN=CC=C2
InChI
InChI=1S/C15H17N3O3S/c1-2-8-17-15(19)12-5-3-6-13(10-12)18-22(20,21)14-7-4-9-16-11-14/h3-7,9-11,18H,2,8H2,1H3,(H,17,19)
InChIKey
LMLYPZLOEZIJGY-UHFFFAOYSA-N
Compound name
N-propyl-3-(pyridin-3-ylsulfonylamino)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

319.09906 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.10634 171.8
[M+Na]+ 342.08828 177.8
[M-H]- 318.09178 176.9
[M+NH4]+ 337.13288 184.1
[M+K]+ 358.06222 173.1
[M+H-H2O]+ 302.09632 163.0
[M+HCOO]- 364.09726 189.9
[M+CH3COO]- 378.11291 206.9
[M+Na-2H]- 340.07373 176.8
[M]+ 319.09851 173.6
[M]- 319.09961 173.6
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