SpectraBase Spectrum ID |
JaUcAcoNGOb |
Name |
Acetic acid, [(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)thio]-, 2-[(E)-1-(4-hydroxyphenyl)ethylidene]hydrazide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
395.141596108 u |
Formula |
C20H21N5O2S |
InChI |
InChI=1S/C20H21N5O2S/c1-3-25-19(16-7-5-4-6-8-16)23-24-20(25)28-13-18(27)22-21-14(2)15-9-11-17(26)12-10-15/h4-12,26H,3,13H2,1-2H3,(H,22,27)/b21-14+ |
InChIKey |
YKEHEKSVOVUPLA-KGENOOAVSA-N |
Molecular Weight |
395.481 g/mol |
SMILES |
N(\N=C\(C=1C=CC(=CC1)O)C)C(CSC=1N(C(=NN1)C=1C=CC=CC1)CC)=O |