CID 3245131

(4-amino-3-ethyl-2-sulfanylidene-5-thiazolyl)-(4-morpholinyl)methanone

Structural Information

Molecular Formula
C10H15N3O2S2
SMILES
CCN1C(=C(SC1=S)C(=O)N2CCOCC2)N
InChI
InChI=1S/C10H15N3O2S2/c1-2-13-8(11)7(17-10(13)16)9(14)12-3-5-15-6-4-12/h2-6,11H2,1H3
InChIKey
YPIWHELEPHBQIM-UHFFFAOYSA-N
Compound name
(4-amino-3-ethyl-2-sulfanylidene-1,3-thiazol-5-yl)-morpholin-4-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

273.06058 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.06786 159.4
[M+Na]+ 296.04980 168.3
[M+NH4]+ 291.09440 166.4
[M+K]+ 312.02374 162.1
[M-H]- 272.05330 162.5
[M+Na-2H]- 294.03525 161.4
[M]+ 273.06003 162.1
[M]- 273.06113 162.1
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.