CID 381977

Nsc669297

Structural Information

Molecular Formula
C18H19N3O2S
SMILES
CC(=O)N1C(CSC1C2=CC=CC=C2)C(=O)NNC3=CC=CC=C3
InChI
InChI=1S/C18H19N3O2S/c1-13(22)21-16(12-24-18(21)14-8-4-2-5-9-14)17(23)20-19-15-10-6-3-7-11-15/h2-11,16,18-19H,12H2,1H3,(H,20,23)
InChIKey
BLKAUWDHKQFPLR-UHFFFAOYSA-N
Compound name
3-acetyl-N',2-diphenyl-1,3-thiazolidine-4-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.1198 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.12708 179.2
[M+Na]+ 364.10902 183.7
[M-H]- 340.11252 187.3
[M+NH4]+ 359.15362 192.4
[M+K]+ 380.08296 178.8
[M+H-H2O]+ 324.11706 170.3
[M+HCOO]- 386.11800 196.1
[M+CH3COO]- 400.13365 211.9
[M+Na-2H]- 362.09447 178.4
[M]+ 341.11925 177.6
[M]- 341.12035 177.6
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.