SpectraBase Spectrum ID |
6zyLfgf22nY |
Name |
N-(3-Methylphenyl)-2-{[5-(phenoxymethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
430.146347136 u |
Formula |
C24H22N4O2S |
InChI |
InChI=1S/C24H22N4O2S/c1-18-9-8-10-19(15-18)25-23(29)17-31-24-27-26-22(16-30-21-13-6-3-7-14-21)28(24)20-11-4-2-5-12-20/h2-15H,16-17H2,1H3,(H,25,29) |
InChIKey |
QSTUOLLGCTZWAJ-UHFFFAOYSA-N |
Molecular Weight |
430.526 g/mol |
SMILES |
N(C(CSC=1N(C(=NN1)COC=1C=CC=CC1)C1=CC=CC=C1)=O)C=1C=C(C)C=CC1 |