CID 13758226

Brn 5614050

Structural Information

Molecular Formula
C16H19N5OS
SMILES
CN(C)CC(=O)N/N=C/C1=C(N=C2N1CCS2)C3=CC=CC=C3
InChI
InChI=1S/C16H19N5OS/c1-20(2)11-14(22)19-17-10-13-15(12-6-4-3-5-7-12)18-16-21(13)8-9-23-16/h3-7,10H,8-9,11H2,1-2H3,(H,19,22)/b17-10+
InChIKey
DCMAFNISAJAXIE-LICLKQGHSA-N
Compound name
2-(dimethylamino)-N-[(E)-(6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

329.13104 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.13832 176.1
[M+Na]+ 352.12026 182.7
[M-H]- 328.12376 184.3
[M+NH4]+ 347.16486 193.1
[M+K]+ 368.09420 179.8
[M+H-H2O]+ 312.12830 167.4
[M+HCOO]- 374.12924 197.0
[M+CH3COO]- 388.14489 217.7
[M+Na-2H]- 350.10571 176.8
[M]+ 329.13049 179.8
[M]- 329.13159 179.8
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.