CID 682128

2-((4-(dimethylamino)phenyl)methylene)thiazolo(3,2-a)benzimidazol-3(2h)-one

Structural Information

Molecular Formula
C18H15N3OS
SMILES
CN(C)C1=CC=C(C=C1)/C=C/2\C(=O)N3C4=CC=CC=C4N=C3S2
InChI
InChI=1S/C18H15N3OS/c1-20(2)13-9-7-12(8-10-13)11-16-17(22)21-15-6-4-3-5-14(15)19-18(21)23-16/h3-11H,1-2H3/b16-11+
InChIKey
SUVAYMBUCQBFFX-LFIBNONCSA-N
Compound name
(2E)-2-[[4-(dimethylamino)phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

321.0936 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 322.10088 172.4
[M+Na]+ 344.08282 188.3
[M+NH4]+ 339.12742 181.7
[M+K]+ 360.05676 181.3
[M-H]- 320.08632 177.7
[M+Na-2H]- 342.06827 180.6
[M]+ 321.09305 176.8
[M]- 321.09415 176.8
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.