SpectraBase Spectrum ID |
2sv1JwTKDjN |
Name |
5-Isoxazolecarboxamide, 3-(4-fluorophenyl)-4,5-dihydro-N-[2-(methylthio)phenyl]- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
330.083827066 u |
Formula |
C17H15FN2O2S |
InChI |
InChI=1S/C17H15FN2O2S/c1-23-16-5-3-2-4-13(16)19-17(21)15-10-14(20-22-15)11-6-8-12(18)9-7-11/h2-9,15H,10H2,1H3,(H,19,21) |
InChIKey |
DSQLHFMOBZMBNO-UHFFFAOYSA-N |
Molecular Weight |
330.377 g/mol |
SMILES |
N(C(C1ON=C(C1)C=1C=CC(=CC1)F)=O)C1=C(SC)C=CC=C1 |