SpectraBase Spectrum ID |
HU5C7pGGZMG |
Name |
N'-[(E)-(4-chlorophenyl)methylidene]-2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
429.102623776 u |
Formula |
C20H20ClN5O2S |
InChI |
InChI=1S/C20H20ClN5O2S/c1-3-26-19(15-6-10-17(28-2)11-7-15)24-25-20(26)29-13-18(27)23-22-12-14-4-8-16(21)9-5-14/h4-12H,3,13H2,1-2H3,(H,23,27)/b22-12+ |
InChIKey |
KVTPZFOTGHFLGE-WSDLNYQXSA-N |
Molecular Weight |
429.926 g/mol |
SMILES |
N(\N=C\C1=CC=C(C=C1)Cl)C(CSC=1N(C(=NN1)C1=CC=C(C=C1)OC)CC)=O |