CID 383251

Nsc671365

Structural Information

Molecular Formula
C17H14N4S
SMILES
C1CN2C(=NC3=CC=CC=C3)C(=NC4=CC=CC=C4)SC2=N1
InChI
InChI=1S/C17H14N4S/c1-3-7-13(8-4-1)19-15-16(20-14-9-5-2-6-10-14)22-17-18-11-12-21(15)17/h1-10H,11-12H2
InChIKey
GFBWUJYYTUBVSP-UHFFFAOYSA-N
Compound name
2-N,3-N-diphenyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2,3-diimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.0939 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.10118 168.6
[M+Na]+ 329.08312 177.5
[M-H]- 305.08662 179.9
[M+NH4]+ 324.12772 186.7
[M+K]+ 345.05706 172.2
[M+H-H2O]+ 289.09116 159.7
[M+HCOO]- 351.09210 190.3
[M+CH3COO]- 365.10775 181.0
[M+Na-2H]- 327.06857 170.8
[M]+ 306.09335 169.4
[M]- 306.09445 169.4
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.