CID 3040029

5-thiazolecarboxamide, n,n-dimethyl-4-phenyl-2-(3-pyridinyl)-, monohydrochloride

Structural Information

Molecular Formula
C17H15N3OS
SMILES
CN(C)C(=O)C1=C(N=C(S1)C2=CN=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C17H15N3OS/c1-20(2)17(21)15-14(12-7-4-3-5-8-12)19-16(22-15)13-9-6-10-18-11-13/h3-11H,1-2H3
InChIKey
KJAHXHRALOUIDJ-UHFFFAOYSA-N
Compound name
N,N-dimethyl-4-phenyl-2-pyridin-3-yl-1,3-thiazole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.0936 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.10088 169.6
[M+Na]+ 332.08282 183.8
[M+NH4]+ 327.12742 178.1
[M+K]+ 348.05676 176.3
[M-H]- 308.08632 175.8
[M+Na-2H]- 330.06827 180.0
[M]+ 309.09305 173.9
[M]- 309.09415 173.9
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.