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]+ 413.05840 189.5
[M+Na]+ 435.04034 193.3
[M-H]- 411.04384 193.6
[M+NH4]+ 430.08494 197.4
[M+K]+ 451.01428 187.9
[M+H-H2O]+ 395.04838 180.7
[M+HCOO]- 457.04932 201.7
[M+CH3COO]- 471.06497 224.2
[M+Na-2H]- 433.02579 193.8
[M]+ 412.05057 188.8
[M]- 412.05167 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.