CID 9623527

4-chloro-n-[2-({(2e)-2-[(4-oxo-4h-chromen-3-yl)methylene]hydrazino}carbonyl)phenyl]benzenesulfonamide

Structural Information

Molecular Formula
C23H16ClN3O5S
SMILES
C1=CC=C2C(=C1)C(=O)C(=CO2)/C=N/NC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=C(C=C4)Cl
InChI
InChI=1S/C23H16ClN3O5S/c24-16-9-11-17(12-10-16)33(30,31)27-20-7-3-1-5-18(20)23(29)26-25-13-15-14-32-21-8-4-2-6-19(21)22(15)28/h1-14,27H,(H,26,29)/b25-13+
InChIKey
RATQAPYLSHKCQX-DHRITJCHSA-N
Compound name
2-[(4-chlorophenyl)sulfonylamino]-N-[(E)-(4-oxochromen-3-yl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

481.04993 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 482.05721 208.9
[M+Na]+ 504.03915 223.5
[M+NH4]+ 499.08375 214.9
[M+K]+ 520.01309 213.8
[M-H]- 480.04265 217.0
[M+Na-2H]- 502.02460 218.6
[M]+ 481.04938 214.0
[M]- 481.05048 214.0
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.