CID 476971

N-[[(5s)-3-[4-(5-cyano-1,2,4-thiadiazol-3-yl)-3-fluoro-phenyl]-2-oxo-oxazolidin-5-yl]methyl]acetamide

Structural Information

Molecular Formula
C15H12FN5O3S
SMILES
CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)C3=NSC(=N3)C#N)F
InChI
InChI=1S/C15H12FN5O3S/c1-8(22)18-6-10-7-21(15(23)24-10)9-2-3-11(12(16)4-9)14-19-13(5-17)25-20-14/h2-4,10H,6-7H2,1H3,(H,18,22)/t10-/m0/s1
InChIKey
AJUIUZHNBLHBJM-JTQLQIEISA-N
Compound name
N-[[(5S)-3-[4-(5-cyano-1,2,4-thiadiazol-3-yl)-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

361.06448 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 362.07176 180.2
[M+Na]+ 384.05370 190.9
[M-H]- 360.05720 184.5
[M+NH4]+ 379.09830 189.8
[M+K]+ 400.02764 186.8
[M+H-H2O]+ 344.06174 163.9
[M+HCOO]- 406.06268 191.1
[M+CH3COO]- 420.07833 188.7
[M+Na-2H]- 382.03915 176.2
[M]+ 361.06393 177.0
[M]- 361.06503 177.0
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.