| SpectraBase Spectrum ID |
B1ntIcpxeNs |
| Name |
4-{(E)-[4-(Dimethylamino)benzylidene]amino}-5-(3,4,5-trimethoxybenzyl)-4H-1,2,4-triazole-3-thiol |
| Alternate Name(s) |
(E)-4-((4-(dimethylamino)benzylidene)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 |
C21H25N5O3S |
| InChI |
InChI=1S/C21H25N5O3S/c1-25(2)16-8-6-14(7-9-16)13-22-26-19(23-24-21(26)30)12-15-10-17(27-3)20(29-5)18(11-15)28-4/h6-11,13H,12H2,1-5H3,(H,24,30)/b22-13+ |
| InChIKey |
RWSGVYHSLVCPCA-LPYMAVHISA-N |
| Literature Reference DOI |
10.1002/cbdv.201700518 |
| Molecular Weight |
427.523 g/mol |
| SMILES |
Sc1[n](\N=C\c2ccc(cc2)N(C)C)c(nn1)Cc1cc(OC)c(c(c1)OC)OC |
| SPLASH |
splash10-0f95-9840000000-91adf2fe177440952811 |
| Source of Spectrum |
CBD-15-SM15-A_23 |
| Wiley ID |
1813230 |
![4-{(E)-[4-(Dimethylamino)benzylidene]amino}-5-(3,4,5-trimethoxybenzyl)-4H-1,2,4-triazole-3-thiol](/api/spectrum/B1ntIcpxeNs/structure.png?h=300&w=458 "4-{(E)-[4-(Dimethylamino)benzylidene]amino}-5-(3,4,5-trimethoxybenzyl)-4H-1,2,4-triazole-3-thiol")
