| SpectraBase Spectrum ID |
AbW0fD6TekT |
| Name |
N-(2,6-Dimethylphenyl)-2-{[4-(4-methylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
428.167082582 u |
| Formula |
C25H24N4OS |
| InChI |
InChI=1S/C25H24N4OS/c1-17-12-14-21(15-13-17)29-24(20-10-5-4-6-11-20)27-28-25(29)31-16-22(30)26-23-18(2)8-7-9-19(23)3/h4-15H,16H2,1-3H3,(H,26,30) |
| InChIKey |
PTXPCHOCKZXYJH-UHFFFAOYSA-N |
| Molecular Weight |
428.554 g/mol |
| SMILES |
N(C=1C(=CC=CC1C)C)C(CSC=1N(C(=NN1)C1=CC=CC=C1)C1=CC=C(C=C1)C)=O |
![N-(2,6-dimethylphenyl)-2-{[4-(4-methylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide](/api/spectrum/AbW0fD6TekT/structure.png?h=300&w=458 "N-(2,6-dimethylphenyl)-2-{[4-(4-methylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide")
