| SpectraBase Spectrum ID |
Gqnu6TvM39C |
| Name |
N-(4-Bromophenyl)-2-{[4-methyl-5-(2-pyridinyl)-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 |
403.010244264 u |
| Formula |
C16H14BrN5OS |
| InChI |
InChI=1S/C16H14BrN5OS/c1-22-15(13-4-2-3-9-18-13)20-21-16(22)24-10-14(23)19-12-7-5-11(17)6-8-12/h2-9H,10H2,1H3,(H,19,23) |
| InChIKey |
KQOGOVZMNSESKA-UHFFFAOYSA-N |
| Molecular Weight |
404.286 g/mol |
| SMILES |
N(C(CSC=1N(C(=NN1)C1=NC=CC=C1)C)=O)C=1C=CC(=CC1)Br |
![N-(4-bromophenyl)-2-{[4-methyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide](/api/spectrum/Gqnu6TvM39C/structure.png?h=300&w=458 "N-(4-bromophenyl)-2-{[4-methyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide")
