CID 13014507

Brn 4532453

Structural Information

Molecular Formula
C10H8N4O2S2
SMILES
C1CSC2=NC=C(C(=O)N21)C(=O)NC3=NC=CS3
InChI
InChI=1S/C10H8N4O2S2/c15-7(13-9-11-1-3-17-9)6-5-12-10-14(8(6)16)2-4-18-10/h1,3,5H,2,4H2,(H,11,13,15)
InChIKey
AYIBHWLRHYIYRU-UHFFFAOYSA-N
Compound name
5-oxo-N-(1,3-thiazol-2-yl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.00888 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.01616 157.2
[M+Na]+ 302.99810 168.5
[M-H]- 279.00160 162.3
[M+NH4]+ 298.04270 174.8
[M+K]+ 318.97204 164.2
[M+H-H2O]+ 263.00614 151.4
[M+HCOO]- 325.00708 170.0
[M+CH3COO]- 339.02273 169.4
[M+Na-2H]- 300.98355 157.7
[M]+ 280.00833 160.6
[M]- 280.00943 160.6
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.