| SpectraBase Spectrum ID |
KbBlSpFb8pl |
| Name |
N'-[(E)-(2,3-dimethoxyphenyl)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 |
455.162725475 u |
| Formula |
C22H25N5O4S |
| InChI |
InChI=1S/C22H25N5O4S/c1-5-27-21(15-9-11-17(29-2)12-10-15)25-26-22(27)32-14-19(28)24-23-13-16-7-6-8-18(30-3)20(16)31-4/h6-13H,5,14H2,1-4H3,(H,24,28)/b23-13+ |
| InChIKey |
WLLMMDDVSOGWTC-YDZHTSKRSA-N |
| Molecular Weight |
455.533 g/mol |
| SMILES |
N(\N=C\C=1C(=C(OC)C=CC1)OC)C(CSC=1N(C(=NN1)C1=CC=C(C=C1)OC)CC)=O |
![N'-[(E)-(2,3-dimethoxyphenyl)methylidene]-2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide](/api/spectrum/KbBlSpFb8pl/structure.png?h=300&w=458 "N'-[(E)-(2,3-dimethoxyphenyl)methylidene]-2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide")
