CID 135459446

Nsc159461

Structural Information

Molecular Formula
C10H11N3O3S2
SMILES
CC1C(=O)NC(=NC2=CC=C(C=C2)S(=O)(=O)N)S1
InChI
InChI=1S/C10H11N3O3S2/c1-6-9(14)13-10(17-6)12-7-2-4-8(5-3-7)18(11,15)16/h2-6H,1H3,(H2,11,15,16)(H,12,13,14)
InChIKey
VYDBXEWEPSTSTA-UHFFFAOYSA-N
Compound name
4-[(5-methyl-4-oxo-1,3-thiazolidin-2-ylidene)amino]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

285.02417 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.03145 161.8
[M+Na]+ 308.01339 170.4
[M-H]- 284.01689 166.8
[M+NH4]+ 303.05799 177.9
[M+K]+ 323.98733 164.4
[M+H-H2O]+ 268.02143 155.5
[M+HCOO]- 330.02237 174.4
[M+CH3COO]- 344.03802 197.2
[M+Na-2H]- 305.99884 162.2
[M]+ 285.02362 160.8
[M]- 285.02472 160.8
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.