CID 377051

Nsc658267

Structural Information

Molecular Formula
C25H24N2S
SMILES
CCC1=C(C(=CC=C1)CC)NC2=NC(=CS2)C3=CC=CC=C3C4=CC=CC=C4
InChI
InChI=1S/C25H24N2S/c1-3-18-13-10-14-19(4-2)24(18)27-25-26-23(17-28-25)22-16-9-8-15-21(22)20-11-6-5-7-12-20/h5-17H,3-4H2,1-2H3,(H,26,27)
InChIKey
BNOSVTIONUROFY-UHFFFAOYSA-N
Compound name
N-(2,6-diethylphenyl)-4-(2-phenylphenyl)-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

384.16602 Da
Monoisotopic Mass

7.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.17330 193.5
[M+Na]+ 407.15524 201.6
[M-H]- 383.15874 205.3
[M+NH4]+ 402.19984 205.9
[M+K]+ 423.12918 193.1
[M+H-H2O]+ 367.16328 183.5
[M+HCOO]- 429.16422 212.5
[M+CH3COO]- 443.17987 203.8
[M+Na-2H]- 405.14069 192.9
[M]+ 384.16547 195.7
[M]- 384.16657 195.7
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

No patent data available for this compound.