CID 9607937

N-[2-({(2e)-2-[4-(benzyloxy)-3-methoxybenzylidene]hydrazino}carbonyl)phenyl]-4-chlorobenzenesulfonamide

Structural Information

Molecular Formula
C28H24ClN3O5S
SMILES
COC1=C(C=CC(=C1)/C=N/NC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)Cl)OCC4=CC=CC=C4
InChI
InChI=1S/C28H24ClN3O5S/c1-36-27-17-21(11-16-26(27)37-19-20-7-3-2-4-8-20)18-30-31-28(33)24-9-5-6-10-25(24)32-38(34,35)23-14-12-22(29)13-15-23/h2-18,32H,19H2,1H3,(H,31,33)/b30-18+
InChIKey
ZQROYOFTOQVOTJ-UXHLAJHPSA-N
Compound name
2-[(4-chlorophenyl)sulfonylamino]-N-[(E)-(3-methoxy-4-phenylmethoxyphenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

549.11255 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 550.11983 229.3
[M+Na]+ 572.10177 234.3
[M-H]- 548.10527 242.4
[M+NH4]+ 567.14637 233.9
[M+K]+ 588.07571 228.0
[M+H-H2O]+ 532.10981 217.7
[M+HCOO]- 594.11075 245.1
[M+CH3COO]- 608.12640 252.2
[M+Na-2H]- 570.08722 232.7
[M]+ 549.11200 236.4
[M]- 549.11310 236.4
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.