CID 3267914

2-[(4-chlorophenyl)sulfonylamino]-n-[(3,4-dimethoxyphenyl)methylideneamino]benzamide

Structural Information

Molecular Formula
C22H20ClN3O5S
SMILES
COC1=C(C=C(C=C1)C=NNC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)Cl)OC
InChI
InChI=1S/C22H20ClN3O5S/c1-30-20-12-7-15(13-21(20)31-2)14-24-25-22(27)18-5-3-4-6-19(18)26-32(28,29)17-10-8-16(23)9-11-17/h3-14,26H,1-2H3,(H,25,27)
InChIKey
CYFNVDHDIUEAJO-UHFFFAOYSA-N
Compound name
2-[(4-chlorophenyl)sulfonylamino]-N-[(3,4-dimethoxyphenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

473.0812 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 474.08848 209.2
[M+Na]+ 496.07042 215.7
[M-H]- 472.07392 220.2
[M+NH4]+ 491.11502 217.7
[M+K]+ 512.04436 210.3
[M+H-H2O]+ 456.07846 199.5
[M+HCOO]- 518.07940 226.0
[M+CH3COO]- 532.09505 238.9
[M+Na-2H]- 494.05587 212.7
[M]+ 473.08065 217.0
[M]- 473.08175 217.0
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.