| SpectraBase Spectrum ID |
GYKwKrYPA9u |
| Name |
4-Phenyl-2-{[4-(4-fluorophenyl)piperazine-1-yl]methyl}-5-(pyridine-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
446.168894102 u |
| Formula |
C24H23FN6S |
| InChI |
InChI=1S/C24H23FN6S/c25-20-8-10-21(11-9-20)29-15-13-28(14-16-29)18-30-24(32)31(22-6-2-1-3-7-22)23(27-30)19-5-4-12-26-17-19/h1-12,17H,13-16,18H2 |
| InChIKey |
LUJNZANRYCHJHC-UHFFFAOYSA-N |
| Molecular Weight |
446.548 g/mol |
| SMILES |
C=1N=CC=CC1C1=NN(C(N1C1=CC=CC=C1)=S)CN1CCN(CC1)C1=CC=C(C=C1)F |
![4-Phenyl-2-{[4-(4-fluorophenyl)piperazine-1-yl]methyl}-5-(pyridine-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione](/api/spectrum/GYKwKrYPA9u/structure.png?h=300&w=458 "4-Phenyl-2-{[4-(4-fluorophenyl)piperazine-1-yl]methyl}-5-(pyridine-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione")
