| SpectraBase Spectrum ID |
2bydBpb0g1J |
| Name |
N-[1,1'-Biphenyl]-2-yl-2-{[5-(4-tert-butylphenyl)-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 |
470.214032775 u |
| Formula |
C28H30N4OS |
| InChI |
InChI=1S/C28H30N4OS/c1-5-32-26(21-15-17-22(18-16-21)28(2,3)4)30-31-27(32)34-19-25(33)29-24-14-10-9-13-23(24)20-11-7-6-8-12-20/h6-18H,5,19H2,1-4H3,(H,29,33) |
| InChIKey |
XNKXSNUHKJWQPG-UHFFFAOYSA-N |
| Molecular Weight |
470.635 g/mol |
| SMILES |
N(C1=C(C2=CC=CC=C2)C=CC=C1)C(CSC=1N(C(=NN1)C=1C=CC(C(C)(C)C)=CC1)CC)=O |
![N-[1,1'-biphenyl]-2-yl-2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide](/api/spectrum/2bydBpb0g1J/structure.png?h=300&w=458 "N-[1,1'-biphenyl]-2-yl-2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide")
