CID 6482331

(s)-n-[[3-(3-fluoro-4-(1,2,4-triazolyl)phenyl)-2-oxo-5-oxazolidinyl]methyl]-4-(2-naphthyl)-4-oxobutanamide

Structural Information

Molecular Formula
C26H22FN5O4
SMILES
C1[C@@H](OC(=O)N1C2=CC(=C(C=C2)N3C=NC=N3)F)CNC(=O)CCC(=O)C4=CC5=CC=CC=C5C=C4
InChI
InChI=1S/C26H22FN5O4/c27-22-12-20(7-8-23(22)32-16-28-15-30-32)31-14-21(36-26(31)35)13-29-25(34)10-9-24(33)19-6-5-17-3-1-2-4-18(17)11-19/h1-8,11-12,15-16,21H,9-10,13-14H2,(H,29,34)/t21-/m0/s1
InChIKey
NBNDSWDFAWDOCL-NRFANRHFSA-N
Compound name
N-[[(5S)-3-[3-fluoro-4-(1,2,4-triazol-1-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-naphthalen-2-yl-4-oxobutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

487.1656 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 488.17288 213.3
[M+Na]+ 510.15482 219.9
[M-H]- 486.15832 222.2
[M+NH4]+ 505.19942 217.0
[M+K]+ 526.12876 214.4
[M+H-H2O]+ 470.16286 200.5
[M+HCOO]- 532.16380 228.6
[M+CH3COO]- 546.17945 220.5
[M+Na-2H]- 508.14027 210.5
[M]+ 487.16505 215.3
[M]- 487.16615 215.3
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.