SpectraBase Spectrum ID |
EPZwNazPaIH |
Name |
2-{[4-Ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2-fluorophenyl)methylidene]acetohydrazide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
413.132174239 u |
Formula |
C20H20FN5O2S |
InChI |
InChI=1S/C20H20FN5O2S/c1-3-26-19(14-8-10-16(28-2)11-9-14)24-25-20(26)29-13-18(27)23-22-12-15-6-4-5-7-17(15)21/h4-12H,3,13H2,1-2H3,(H,23,27)/b22-12+ |
InChIKey |
VDLWRNLIQYXGDJ-WSDLNYQXSA-N |
Molecular Weight |
413.471 g/mol |
SMILES |
N(\N=C\C=1C(F)=CC=CC1)C(CSC=1N(C(=NN1)C=1C=CC(=CC1)OC)CC)=O |