SpectraBase Spectrum ID |
5XxWhq1SbCR |
Name |
N-(4-Ethoxyphenyl)-2-[(4-ethyl-5-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 |
382.146347136 u |
Formula |
C20H22N4O2S |
InChI |
InChI=1S/C20H22N4O2S/c1-3-24-19(15-8-6-5-7-9-15)22-23-20(24)27-14-18(25)21-16-10-12-17(13-11-16)26-4-2/h5-13H,3-4,14H2,1-2H3,(H,21,25) |
InChIKey |
OROXEFABSSXTTR-UHFFFAOYSA-N |
Molecular Weight |
382.482 g/mol |
SMILES |
N(C(CSC=1N(C(=NN1)C1=CC=CC=C1)CC)=O)C=1C=CC(=CC1)OCC |