CID 3062335

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

Structural Information

Molecular Formula
C14H22N6OS
SMILES
C1CCC(CC1)NC(=O)N2CCC3=C(C2)SC(=N3)N=C(N)N
InChI
InChI=1S/C14H22N6OS/c15-12(16)19-13-18-10-6-7-20(8-11(10)22-13)14(21)17-9-4-2-1-3-5-9/h9H,1-8H2,(H,17,21)(H4,15,16,18,19)
InChIKey
QCXNBYRUMAYSHF-UHFFFAOYSA-N
Compound name
N-cyclohexyl-2-(diaminomethylideneamino)-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

8
Patents

322.1576 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.16488 169.4
[M+Na]+ 345.14682 174.0
[M+NH4]+ 340.19142 175.9
[M+K]+ 361.12076 170.2
[M-H]- 321.15032 172.8
[M+Na-2H]- 343.13227 172.2
[M]+ 322.15705 170.7
[M]- 322.15815 170.7
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