| SpectraBase Spectrum ID |
QagvRLgT2h |
| Name |
2-{[5-(4-Tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dimethylphenyl)acetamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
408.198382711 u |
| Formula |
C23H28N4OS |
| InChI |
InChI=1S/C23H28N4OS/c1-15-7-8-16(2)19(13-15)24-20(28)14-29-22-26-25-21(27(22)6)17-9-11-18(12-10-17)23(3,4)5/h7-13H,14H2,1-6H3,(H,24,28) |
| InChIKey |
KUGKVDKSZALFMV-UHFFFAOYSA-N |
| Molecular Weight |
408.564 g/mol |
| SMILES |
N(C1=C(C=CC(=C1)C)C)C(CSC=1N(C(=NN1)C=1C=CC(C(C)(C)C)=CC1)C)=O |
![2-{[5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dimethylphenyl)acetamide](/api/spectrum/QagvRLgT2h/structure.png?h=300&w=458 "2-{[5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dimethylphenyl)acetamide")
