| SpectraBase Spectrum ID |
KkUnPcj13lN |
| Name |
N-{3-[4-Methyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]phenyl}benzamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
324.104482324 u |
| Formula |
C17H16N4OS |
| InChI |
InChI=1S/C17H16N4OS/c1-21-15(19-20-17(21)23-2)13-9-6-10-14(11-13)18-16(22)12-7-4-3-5-8-12/h3-11H,1-2H3,(H,18,22) |
| InChIKey |
LQEIQESQQCQWIC-UHFFFAOYSA-N |
| Molecular Weight |
324.402 g/mol |
| SMILES |
N(C(=O)C1=CC=CC=C1)C1=CC(C=2N(C(=NN2)SC)C)=CC=C1 |
![N-{3-[4-methyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]phenyl}benzamide](/api/spectrum/KkUnPcj13lN/structure.png?h=300&w=458 "N-{3-[4-methyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]phenyl}benzamide")
