| SpectraBase Spectrum ID |
AkLtzHmaw98 |
| Name |
4-{[(E)-(2-bromophenyl)methylidene]amino}-5-(3-methoxyphenyl)-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 |
387.999345228 u |
| Formula |
C16H13BrN4OS |
| InChI |
InChI=1S/C16H13BrN4OS/c1-22-13-7-4-6-11(9-13)15-19-20-16(23)21(15)18-10-12-5-2-3-8-14(12)17/h2-10H,1H3,(H,20,23)/b18-10+ |
| InChIKey |
HLWGMWRRQMUHLR-VCHYOVAHSA-N |
| Molecular Weight |
389.271 g/mol |
| SMILES |
SC=1N(C(=NN1)C1=CC(OC)=CC=C1)\N=C\C=1C(Br)=CC=CC1 |
![4-{[(E)-(2-bromophenyl)methylidene]amino}-5-(3-methoxyphenyl)-4H-1,2,4-triazole-3-thiol](/api/spectrum/AkLtzHmaw98/structure.png?h=300&w=458 "4-{[(E)-(2-bromophenyl)methylidene]amino}-5-(3-methoxyphenyl)-4H-1,2,4-triazole-3-thiol")
