CID 4177760

2-[(4-chlorophenyl)sulfonylamino]-n-(naphthalen-1-ylmethylideneamino)benzamide

Structural Information

Molecular Formula
C24H18ClN3O3S
SMILES
C1=CC=C2C(=C1)C=CC=C2C=NNC(=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)
InChIKey
KARYPGHOJAEGJX-UHFFFAOYSA-N
Compound name
2-[(4-chlorophenyl)sulfonylamino]-N-(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]+ 464.08302 206.5
[M+Na]+ 486.06496 213.5
[M-H]- 462.06846 217.7
[M+NH4]+ 481.10956 216.2
[M+K]+ 502.03890 206.0
[M+H-H2O]+ 446.07300 197.0
[M+HCOO]- 508.07394 222.1
[M+CH3COO]- 522.08959 236.9
[M+Na-2H]- 484.05041 212.9
[M]+ 463.07519 211.0
[M]- 463.07629 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.