CID 9569901

Nsc623230

Structural Information

Molecular Formula
C20H18N4O4S2
SMILES
C1=CC=C(C=C1)S(=O)(=O)N/N=C/C2=CC(=CC=C2)/C=N/NS(=O)(=O)C3=CC=CC=C3
InChI
InChI=1S/C20H18N4O4S2/c25-29(26,19-10-3-1-4-11-19)23-21-15-17-8-7-9-18(14-17)16-22-24-30(27,28)20-12-5-2-6-13-20/h1-16,23-24H/b21-15+,22-16+
InChIKey
JKCGIPKBFKFLJD-YHARCJFQSA-N
Compound name
N-[(E)-[3-[(E)-(benzenesulfonylhydrazinylidene)methyl]phenyl]methylideneamino]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

442.07693 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 443.08421 201.4
[M+Na]+ 465.06615 206.6
[M-H]- 441.06965 211.8
[M+NH4]+ 460.11075 209.9
[M+K]+ 481.04009 199.3
[M+H-H2O]+ 425.07419 190.7
[M+HCOO]- 487.07513 219.6
[M+CH3COO]- 501.09078 233.0
[M+Na-2H]- 463.05160 210.3
[M]+ 442.07638 203.5
[M]- 442.07748 203.5
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.