| SpectraBase Spectrum ID |
HgtYjnFfQSF |
| Name |
1-{[-4-Benzyl-5-(4-pyridyl)-4H-1,2,4-triazole-3-ylthiomethylcarboxyl]-3,5-dimethyl-1H-pyrazole |
| Alternate Name(s) |
1-(3,5-dimethyl-1-pyrazolyl)-2-[[4-(phenylmethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]ethanone
2-[(4-benzyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(3,5-dimethylpyrazol-1-yl)ethanone
2-[[4-benzyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(3,5-dimethylpyrazol-1-yl)ethanone
1-(3,5-dimethylpyrazol-1-yl)-2-[[4-(phenylmethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H20N6OS |
| InChI |
InChI=1S/C21H20N6OS/c1-15-12-16(2)27(25-15)19(28)14-29-21-24-23-20(18-8-10-22-11-9-18)26(21)13-17-6-4-3-5-7-17/h3-12H,13-14H2,1-2H3 |
| InChIKey |
YQPXLOZKPCVEOP-UHFFFAOYSA-N |
| Molecular Weight |
404.492 g/mol |
| SMILES |
c1([n](c(nn1)SCC([n]1nc(C)cc1C)=O)Cc1ccccc1)-c1ccncc1 |
| SPLASH |
splash10-00l6-0089000000-680dc42504160c816d34 |
| Source of Spectrum |
Y-48-1369-5c |
| Wiley ID |
1704627 |
![1-{[-4-Benzyl-5-(4-pyridyl)-4H-1,2,4-triazole-3-ylthiomethylcarboxyl]-3,5-dimethyl-1H-pyrazole](/api/spectrum/HgtYjnFfQSF/structure.png?h=300&w=458 "1-{[-4-Benzyl-5-(4-pyridyl)-4H-1,2,4-triazole-3-ylthiomethylcarboxyl]-3,5-dimethyl-1H-pyrazole")
