CID 5828196

4-{5-[(z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzenesulfonamide

Structural Information

Molecular Formula
C14H10N2O5S2
SMILES
C1=CC(=CC=C1C2=CC=C(O2)/C=C\3/C(=O)NC(=O)S3)S(=O)(=O)N
InChI
InChI=1S/C14H10N2O5S2/c15-23(19,20)10-4-1-8(2-5-10)11-6-3-9(21-11)7-12-13(17)16-14(18)22-12/h1-7H,(H2,15,19,20)(H,16,17,18)/b12-7-
InChIKey
JNPRTUHVCHGFHJ-GHXNOFRVSA-N
Compound name
4-[5-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

9
Patents

350.0031 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.01038 179.7
[M+Na]+ 372.99232 189.5
[M-H]- 348.99582 188.2
[M+NH4]+ 368.03692 193.4
[M+K]+ 388.96626 184.1
[M+H-H2O]+ 333.00036 175.0
[M+HCOO]- 395.00130 191.4
[M+CH3COO]- 409.01695 203.1
[M+Na-2H]- 370.97777 178.0
[M]+ 350.00255 181.0
[M]- 350.00365 181.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe