CID 3043053

54996-16-6

Structural Information

Molecular Formula
C14H12N4O2S
SMILES
C1=CC2=C(C=CC(=N2)NS(=O)(=O)C3=CC=C(C=C3)N)N=C1
InChI
InChI=1S/C14H12N4O2S/c15-10-3-5-11(6-4-10)21(19,20)18-14-8-7-12-13(17-14)2-1-9-16-12/h1-9H,15H2,(H,17,18)
InChIKey
VPCBJWMPLZYLSE-UHFFFAOYSA-N
Compound name
4-amino-N-(1,5-naphthyridin-2-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

300.06808 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.07536 163.5
[M+Na]+ 323.05730 177.0
[M+NH4]+ 318.10190 170.9
[M+K]+ 339.03124 168.8
[M-H]- 299.06080 167.6
[M+Na-2H]- 321.04275 172.6
[M]+ 300.06753 167.0
[M]- 300.06863 167.0
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

No patent data available for this compound.