CID 11820793

Acetic acid, (pyrazinyloxy)-, [(2z)-3-(2,4-dichlorophenyl)-4-oxo-2-thiazolidinylidene]hydrazide

Structural Information

Molecular Formula
C15H11Cl2N5O3S
SMILES
C1C(=O)N(/C(=N/NC(=O)COC2=NC=CN=C2)/S1)C3=C(C=C(C=C3)Cl)Cl
InChI
InChI=1S/C15H11Cl2N5O3S/c16-9-1-2-11(10(17)5-9)22-14(24)8-26-15(22)21-20-12(23)7-25-13-6-18-3-4-19-13/h1-6H,7-8H2,(H,20,23)/b21-15-
InChIKey
XEBWPKXRXJZWLY-QNGOZBTKSA-N
Compound name
N-[(Z)-[3-(2,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-2-ylidene]amino]-2-pyrazin-2-yloxyacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

410.99597 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 412.00325 189.1
[M+Na]+ 433.98519 198.0
[M-H]- 409.98869 196.3
[M+NH4]+ 429.02979 199.2
[M+K]+ 449.95913 191.8
[M+H-H2O]+ 393.99323 180.0
[M+HCOO]- 455.99417 197.4
[M+CH3COO]- 470.00982 198.4
[M+Na-2H]- 431.97064 188.7
[M]+ 410.99542 194.2
[M]- 410.99652 194.2
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

No patent data available for this compound.