CID 3062334

Thiazolo(5,4-c)pyridine-5(4h)-carboxamide, 6,7-dihydro-2-((aminoiminomethyl)amino)-n-methyl-

Structural Information

Molecular Formula
C9H14N6OS
SMILES
CNC(=O)N1CCC2=C(C1)SC(=N2)N=C(N)N
InChI
InChI=1S/C9H14N6OS/c1-12-9(16)15-3-2-5-6(4-15)17-8(13-5)14-7(10)11/h2-4H2,1H3,(H,12,16)(H4,10,11,13,14)
InChIKey
FTJBELIYPFVLBM-UHFFFAOYSA-N
Compound name
2-(diaminomethylideneamino)-N-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

254.09499 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.10227 153.0
[M+Na]+ 277.08421 158.3
[M+NH4]+ 272.12881 159.2
[M+K]+ 293.05815 155.3
[M-H]- 253.08771 154.3
[M+Na-2H]- 275.06966 155.0
[M]+ 254.09444 153.8
[M]- 254.09554 153.8
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

patents stripe