CID 3265587

2-[(4-chlorophenyl)sulfonylamino]-n-[(4-ethoxyphenyl)methylideneamino]benzamide

Structural Information

Molecular Formula
C22H20ClN3O4S
SMILES
CCOC1=CC=C(C=C1)C=NNC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C22H20ClN3O4S/c1-2-30-18-11-7-16(8-12-18)15-24-25-22(27)20-5-3-4-6-21(20)26-31(28,29)19-13-9-17(23)10-14-19/h3-15,26H,2H2,1H3,(H,25,27)
InChIKey
LLAKKZRTXXAFID-UHFFFAOYSA-N
Compound name
2-[(4-chlorophenyl)sulfonylamino]-N-[(4-ethoxyphenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

457.0863 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 458.09358 206.2
[M+Na]+ 480.07552 212.4
[M-H]- 456.07902 216.9
[M+NH4]+ 475.12012 215.3
[M+K]+ 496.04946 206.0
[M+H-H2O]+ 440.08356 196.6
[M+HCOO]- 502.08450 222.9
[M+CH3COO]- 516.10015 235.3
[M+Na-2H]- 478.06097 210.1
[M]+ 457.08575 212.3
[M]- 457.08685 212.3
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.