CID 135537728

Benzenesulfonic acid, (1,2-dihydro-1-((4-methylphenyl)sulfonyl)-2-oxo-3h-indol-3-ylidene)hydrazide

Structural Information

Molecular Formula
C21H17N3O5S2
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3C(=C2O)N=NS(=O)(=O)C4=CC=CC=C4
InChI
InChI=1S/C21H17N3O5S2/c1-15-11-13-17(14-12-15)31(28,29)24-19-10-6-5-9-18(19)20(21(24)25)22-23-30(26,27)16-7-3-2-4-8-16/h2-14,25H,1H3
InChIKey
BYZDHWJWISRQEJ-UHFFFAOYSA-N
Compound name
N-[2-hydroxy-1-(4-methylphenyl)sulfonylindol-3-yl]iminobenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

455.06097 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 456.06825 203.0
[M+Na]+ 478.05019 215.8
[M+NH4]+ 473.09479 208.7
[M+K]+ 494.02413 207.8
[M-H]- 454.05369 207.8
[M+Na-2H]- 476.03564 212.2
[M]+ 455.06042 207.1
[M]- 455.06152 207.1
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.