| SpectraBase Spectrum ID |
3ES73wnFRRJ |
| Name |
2-{[4-Ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(4-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(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 |
KIHVDFOYWUQUFT-WSDLNYQXSA-N |
| Molecular Weight |
413.471 g/mol |
| SMILES |
N(\N=C\C1=CC=C(C=C1)F)C(CSC=1N(C(=NN1)C1=CC=C(C=C1)OC)CC)=O |
![2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(4-fluorophenyl)methylidene]acetohydrazide](/api/spectrum/3ES73wnFRRJ/structure.png?h=300&w=458 "2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(4-fluorophenyl)methylidene]acetohydrazide")
