| SpectraBase Spectrum ID |
6ALxrqSSbKe |
| Name |
N'-[(Z)-1-(4-bromophenyl)ethylidene]-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 |
487.067759140 u |
| Formula |
C21H22BrN5O2S |
| InChI |
InChI=1S/C21H22BrN5O2S/c1-4-27-20(16-7-11-18(29-3)12-8-16)25-26-21(27)30-13-19(28)24-23-14(2)15-5-9-17(22)10-6-15/h5-12H,4,13H2,1-3H3,(H,24,28)/b23-14- |
| InChIKey |
NOQAALWRJWYBOP-UCQKPKSFSA-N |
| Molecular Weight |
488.404 g/mol |
| SMILES |
N(\N=C/(C1=CC=C(C=C1)Br)C)C(CSC=1N(C(=NN1)C1=CC=C(C=C1)OC)CC)=O |
![N'-[(Z)-1-(4-bromophenyl)ethylidene]-2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide](/api/spectrum/6ALxrqSSbKe/structure.png?h=300&w=458 "N'-[(Z)-1-(4-bromophenyl)ethylidene]-2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide")
