| SpectraBase Spectrum ID |
1G50F7vWul1 |
| Name |
2-{[5-(4-Tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-isopropylphenyl)acetamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
436.229682839 u |
| Formula |
C25H32N4OS |
| InChI |
InChI=1S/C25H32N4OS/c1-7-29-23(18-12-14-19(15-13-18)25(4,5)6)27-28-24(29)31-16-22(30)26-21-11-9-8-10-20(21)17(2)3/h8-15,17H,7,16H2,1-6H3,(H,26,30) |
| InChIKey |
ORIOULGXXIUSMK-UHFFFAOYSA-N |
| Molecular Weight |
436.618 g/mol |
| SMILES |
N(C1=C(C(C)C)C=CC=C1)C(CSC=1N(C(=NN1)C1=CC=C(C(C)(C)C)C=C1)CC)=O |
![2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-isopropylphenyl)acetamide](/api/spectrum/1G50F7vWul1/structure.png?h=300&w=458 "2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-isopropylphenyl)acetamide")
