CID 1498381

Brn 1016890

Structural Information

Molecular Formula
C18H14N4S
SMILES
C1=CC=C(C=C1)C2=NN(C(=C2)N)C3=NC(=CS3)C4=CC=CC=C4
InChI
InChI=1S/C18H14N4S/c19-17-11-15(13-7-3-1-4-8-13)21-22(17)18-20-16(12-23-18)14-9-5-2-6-10-14/h1-12H,19H2
InChIKey
NJWHHZBUUTZLJM-UHFFFAOYSA-N
Compound name
5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)pyrazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.0939 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.10118 170.6
[M+Na]+ 341.08312 187.0
[M+NH4]+ 336.12772 179.6
[M+K]+ 357.05706 180.0
[M-H]- 317.08662 178.6
[M+Na-2H]- 339.06857 183.1
[M]+ 318.09335 175.9
[M]- 318.09445 175.9
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.