SpectraBase Spectrum ID |
2SmCCFrzRWZ |
Name |
Ethanone, 1-(benzofuran-2-yl)-2-(4-methyl-5-phenyl-4H-[1,2,4]triazol-3-ylsulfanyl)- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
349.088497907 u |
Formula |
C19H15N3O2S |
InChI |
InChI=1S/C19H15N3O2S/c1-22-18(13-7-3-2-4-8-13)20-21-19(22)25-12-15(23)17-11-14-9-5-6-10-16(14)24-17/h2-11H,12H2,1H3 |
InChIKey |
BLNIIISLHWDRRU-UHFFFAOYSA-N |
Molecular Weight |
349.408 g/mol |
SMILES |
C1(=NN=C(N1C)C1=CC=CC=C1)SCC(=O)C1=CC2=CC=CC=C2O1 |