CID 3051938

68173-65-9

Structural Information

Molecular Formula
C24H17N3S2
SMILES
C1=CC=C(C=C1)C2=CSC(=N2)NC3=CC=C(C=C3)C4=CSC(=N4)C5=CC=CC=C5
InChI
InChI=1S/C24H17N3S2/c1-3-7-17(8-4-1)22-16-29-24(27-22)25-20-13-11-18(12-14-20)21-15-28-23(26-21)19-9-5-2-6-10-19/h1-16H,(H,25,27)
InChIKey
HKAYQUJVPIPZET-UHFFFAOYSA-N
Compound name
4-phenyl-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

411.0864 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 412.09368 193.1
[M+Na]+ 434.07562 204.9
[M-H]- 410.07912 207.8
[M+NH4]+ 429.12022 205.4
[M+K]+ 450.04956 195.5
[M+H-H2O]+ 394.08366 184.9
[M+HCOO]- 456.08460 210.3
[M+CH3COO]- 470.10025 204.2
[M+Na-2H]- 432.06107 192.8
[M]+ 411.08585 196.6
[M]- 411.08695 196.6
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.