CID 9651444

4-cl-n-(2-((2-(1-naphthylmethylene)hydrazino)carbonyl)phenyl)benzenesulfonamide

Structural Information

Molecular Formula
C24H18ClN3O3S
SMILES
C1=CC=C2C(=C1)C=CC=C2/C=N/NC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=C(C=C4)Cl
InChI
InChI=1S/C24H18ClN3O3S/c25-19-12-14-20(15-13-19)32(30,31)28-23-11-4-3-10-22(23)24(29)27-26-16-18-8-5-7-17-6-1-2-9-21(17)18/h1-16,28H,(H,27,29)/b26-16+
InChIKey
KARYPGHOJAEGJX-WGOQTCKBSA-N
Compound name
2-[(4-chlorophenyl)sulfonylamino]-N-[(E)-naphthalen-1-ylmethylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

463.07574 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 464.083016 206.5
[M+Na]+ 486.064958 213.5
[M-H]- 462.068464 217.7
[M+NH4]+ 481.109563 216.2
[M+K]+ 502.038898 206.0
[M+H-H2O]+ 446.073000 197.0
[M+HCOO]- 508.073941 222.1
[M+CH3COO]- 522.089591 236.9
[M+Na-2H]- 484.050406 212.9
[M]+ 463.07519142 211.0
[M]- 463.07628858 211.0
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.