| SpectraBase Spectrum ID |
GaTHA18of2N |
| Name |
4-[(E)-(4-Nitrobenzylidene)amino]-5-(3,4,5-trimethoxybenzyl)-4H-1,2,4-triazole-3-thiol |
| Alternate Name(s) |
(E)-4-((4-nitrobenzylidene)amino)-5-(3,4,5-trimethoxybenzyl)-4H-1,2,4-triazole-3-thiol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H19N5O5S |
| InChI |
InChI=1S/C19H19N5O5S/c1-27-15-8-13(9-16(28-2)18(15)29-3)10-17-21-22-19(30)23(17)20-11-12-4-6-14(7-5-12)24(25)26/h4-9,11H,10H2,1-3H3,(H,22,30)/b20-11+ |
| InChIKey |
IKMHQDCHOINATC-RGVLZGJSSA-N |
| Literature Reference DOI |
10.1002/cbdv.201700518 |
| Molecular Weight |
429.451 g/mol |
| SMILES |
Sc1[n](c(nn1)Cc1cc(OC)c(c(c1)OC)OC)\N=C\c1ccc(cc1)[N+]([O-])=O |
| SPLASH |
splash10-00ls-9770000000-3101453ab5e61e01bf56 |
| Source of Spectrum |
CBD-15-SM11-A_21 |
| Wiley ID |
1813228 |
![4-[(E)-(4-Nitrobenzylidene)amino]-5-(3,4,5-trimethoxybenzyl)-4H-1,2,4-triazole-3-thiol](/api/spectrum/GaTHA18of2N/structure.png?h=300&w=458 "4-[(E)-(4-Nitrobenzylidene)amino]-5-(3,4,5-trimethoxybenzyl)-4H-1,2,4-triazole-3-thiol")
