CID 9569815

Nsc620025

Structural Information

Molecular Formula
C17H19N5OS
SMILES
CC1=CSC2=NC(=C(N12)/C=N/NC(=O)CN(C)C)C3=CC=CC=C3
InChI
InChI=1S/C17H19N5OS/c1-12-11-24-17-19-16(13-7-5-4-6-8-13)14(22(12)17)9-18-20-15(23)10-21(2)3/h4-9,11H,10H2,1-3H3,(H,20,23)/b18-9+
InChIKey
DDRJXOZJRMQGDP-GIJQJNRQSA-N
Compound name
2-(dimethylamino)-N-[(E)-(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.13104 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.13832 180.4
[M+Na]+ 364.12026 189.4
[M-H]- 340.12376 189.7
[M+NH4]+ 359.16486 197.4
[M+K]+ 380.09420 185.8
[M+H-H2O]+ 324.12830 171.9
[M+HCOO]- 386.12924 203.7
[M+CH3COO]- 400.14489 221.2
[M+Na-2H]- 362.10571 181.6
[M]+ 341.13049 187.6
[M]- 341.13159 187.6
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.