CID 43706

Oxamide, n-(p-aminobenzylsulfonyl)-n'-(p-aminophenylsulfonyl)-

Structural Information

Molecular Formula
C15H16N4O6S2
SMILES
C1=CC(=CC=C1CS(=O)(=O)NC(=O)C(=O)NS(=O)(=O)C2=CC=C(C=C2)N)N
InChI
InChI=1S/C15H16N4O6S2/c16-11-3-1-10(2-4-11)9-26(22,23)18-14(20)15(21)19-27(24,25)13-7-5-12(17)6-8-13/h1-8H,9,16-17H2,(H,18,20)(H,19,21)
InChIKey
ISAJYPYXXQRAFP-UHFFFAOYSA-N
Compound name
N-[(4-aminophenyl)methylsulfonyl]-N'-(4-aminophenyl)sulfonyloxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

412.05112 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 413.058396 189.5
[M+Na]+ 435.040338 193.3
[M-H]- 411.043844 193.6
[M+NH4]+ 430.084943 197.4
[M+K]+ 451.014278 187.9
[M+H-H2O]+ 395.048380 180.7
[M+HCOO]- 457.049321 201.7
[M+CH3COO]- 471.064971 224.2
[M+Na-2H]- 433.025786 193.8
[M]+ 412.05057142 188.8
[M]- 412.05166858 188.8
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.