| SpectraBase Spectrum ID |
HuNsGFAcDHd |
| Name |
N-(2-Tert-butylphenyl)-2-{[5-(3-chlorophenyl)-4-ethyl-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 |
428.143760314 u |
| Formula |
C22H25ClN4OS |
| InChI |
InChI=1S/C22H25ClN4OS/c1-5-27-20(15-9-8-10-16(23)13-15)25-26-21(27)29-14-19(28)24-18-12-7-6-11-17(18)22(2,3)4/h6-13H,5,14H2,1-4H3,(H,24,28) |
| InChIKey |
BTSIEEMNJYKPPL-UHFFFAOYSA-N |
| Molecular Weight |
428.982 g/mol |
| SMILES |
N(C1=C(C(C)(C)C)C=CC=C1)C(CSC=1N(C(=NN1)C1=CC(Cl)=CC=C1)CC)=O |
![N-(2-tert-butylphenyl)-2-{[5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide](/api/spectrum/HuNsGFAcDHd/structure.png?h=300&w=458 "N-(2-tert-butylphenyl)-2-{[5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide")
