| SpectraBase Spectrum ID |
9TLio0QpjUm |
| Name |
N-(4-Fluorophenyl)-2-[(5-isopropyl-4-methyl-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 |
308.110710519 u |
| Formula |
C14H17FN4OS |
| InChI |
InChI=1S/C14H17FN4OS/c1-9(2)13-17-18-14(19(13)3)21-8-12(20)16-11-6-4-10(15)5-7-11/h4-7,9H,8H2,1-3H3,(H,16,20) |
| InChIKey |
YEUPDQVDTWEDCX-UHFFFAOYSA-N |
| Molecular Weight |
308.375 g/mol |
| SMILES |
N(C(CSC=1N(C(=NN1)C(C)C)C)=O)C1=CC=C(C=C1)F |
![N-(4-fluorophenyl)-2-[(5-isopropyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide](/api/spectrum/9TLio0QpjUm/structure.png?h=300&w=458 "N-(4-fluorophenyl)-2-[(5-isopropyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide")
