CID 9574634

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

Structural Information

Molecular Formula
C14H17N5O2S2
SMILES
CCCCN\1C(=O)CS/C1=N/NC(=O)C2=C(N=C3N2C=CS3)C
InChI
InChI=1S/C14H17N5O2S2/c1-3-4-5-18-10(20)8-23-14(18)17-16-12(21)11-9(2)15-13-19(11)6-7-22-13/h6-7H,3-5,8H2,1-2H3,(H,16,21)/b17-14+
InChIKey
OOZWQRVIUDUJDC-SAPNQHFASA-N
Compound name
N-[(E)-(3-butyl-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

351.08237 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.08965 180.5
[M+Na]+ 374.07159 191.1
[M-H]- 350.07509 187.4
[M+NH4]+ 369.11619 197.9
[M+K]+ 390.04553 187.2
[M+H-H2O]+ 334.07963 174.8
[M+HCOO]- 396.08057 195.2
[M+CH3COO]- 410.09622 214.5
[M+Na-2H]- 372.05704 176.8
[M]+ 351.08182 187.3
[M]- 351.08292 187.3
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.