| SpectraBase Spectrum ID |
2BUXsfhhoPh |
| Name |
4-{[(E)-(3-bromo-4-methoxyphenyl)methylidene]amino}-5-(4-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
432.025559975 u |
| Formula |
C18H17BrN4O2S |
| InChI |
InChI=1S/C18H17BrN4O2S/c1-3-25-14-7-5-13(6-8-14)17-21-22-18(26)23(17)20-11-12-4-9-16(24-2)15(19)10-12/h4-11H,3H2,1-2H3,(H,22,26)/b20-11+ |
| InChIKey |
JODFVTNPUPIRSZ-RGVLZGJSSA-N |
| Molecular Weight |
433.324 g/mol |
| SMILES |
SC=1N(C(=NN1)C=1C=CC(=CC1)OCC)\N=C\C=1C=C(Br)C(=CC1)OC |
![4-{[(E)-(3-bromo-4-methoxyphenyl)methylidene]amino}-5-(4-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol](/api/spectrum/2BUXsfhhoPh/structure.png?h=300&w=458 "4-{[(E)-(3-bromo-4-methoxyphenyl)methylidene]amino}-5-(4-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol")
