CID 9574632

N-[(e)-(3-ethyl-4-oxo-thiazolidin-2-ylidene)amino]-6-methyl-imidazo[2,1-b]thiazole-5-carboxamide

Structural Information

Molecular Formula
C12H13N5O2S2
SMILES
CCN\1C(=O)CS/C1=N/NC(=O)C2=C(N=C3N2C=CS3)C
InChI
InChI=1S/C12H13N5O2S2/c1-3-16-8(18)6-21-12(16)15-14-10(19)9-7(2)13-11-17(9)4-5-20-11/h4-5H,3,6H2,1-2H3,(H,14,19)/b15-12+
InChIKey
HJYXAADZNAXPQE-NTCAYCPXSA-N
Compound name
N-[(E)-(3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene)amino]-6-methylimidazo[2,1-b][1,3]thiazole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

323.05106 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.05834 172.5
[M+Na]+ 346.04028 184.1
[M-H]- 322.04378 179.8
[M+NH4]+ 341.08488 191.1
[M+K]+ 362.01422 180.6
[M+H-H2O]+ 306.04832 167.2
[M+HCOO]- 368.04926 187.9
[M+CH3COO]- 382.06491 184.7
[M+Na-2H]- 344.02573 169.6
[M]+ 323.05051 178.8
[M]- 323.05161 178.8
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.