| SpectraBase Spectrum ID |
IiFE38e89y9 |
| Name |
2-{[5-(4-Tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-fluoro-4-methylphenyl)acetamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
412.173310777 u |
| Formula |
C22H25FN4OS |
| InChI |
InChI=1S/C22H25FN4OS/c1-14-6-11-17(12-18(14)23)24-19(28)13-29-21-26-25-20(27(21)5)15-7-9-16(10-8-15)22(2,3)4/h6-12H,13H2,1-5H3,(H,24,28) |
| InChIKey |
ZRLNJSQVKLXGDQ-UHFFFAOYSA-N |
| Molecular Weight |
412.527 g/mol |
| SMILES |
N(C(CSC=1N(C(=NN1)C1=CC=C(C(C)(C)C)C=C1)C)=O)C1=CC(F)=C(C=C1)C |
![2-{[5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-fluoro-4-methylphenyl)acetamide](/api/spectrum/IiFE38e89y9/structure.png?h=300&w=458 "2-{[5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-fluoro-4-methylphenyl)acetamide")
