CID 2060703

N-allyl-4-amino-3-ethyl-2-thioxo-2,3-dihydro-1,3-thiazole-5-carboxamide

Structural Information

Molecular Formula
C9H13N3OS2
SMILES
CCN1C(=C(SC1=S)C(=O)NCC=C)N
InChI
InChI=1S/C9H13N3OS2/c1-3-5-11-8(13)6-7(10)12(4-2)9(14)15-6/h3H,1,4-5,10H2,2H3,(H,11,13)
InChIKey
DHKWUZURZXZIQS-UHFFFAOYSA-N
Compound name
4-amino-3-ethyl-N-prop-2-enyl-2-sulfanylidene-1,3-thiazole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

243.05 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.05728 155.5
[M+Na]+ 266.03922 163.1
[M+NH4]+ 261.08382 162.1
[M+K]+ 282.01316 156.2
[M-H]- 242.04272 156.3
[M+Na-2H]- 264.02467 156.9
[M]+ 243.04945 157.2
[M]- 243.05055 157.2
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.