| SpectraBase Spectrum ID |
3BllZ4MApfE |
| Name |
Acetamide, 2-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)thio]-N-[3-(trifluoromethyl)phenyl]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
379.096617809 u |
| Formula |
C18H16F3N3OS |
| InChI |
InChI=1S/C18H16F3N3OS/c1-10-11(2)15(8-22)17(23-12(10)3)26-9-16(25)24-14-6-4-5-13(7-14)18(19,20)21/h4-7H,9H2,1-3H3,(H,24,25) |
| InChIKey |
DKJNGTOPGSMJGL-UHFFFAOYSA-N |
| Molecular Weight |
379.401 g/mol |
| SMILES |
N(C(CSC1=C(C(=C(C(C)=N1)C)C)C#N)=O)C=1C=C(C(F)(F)F)C=CC1 |
![acetamide, 2-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)thio]-N-[3-(trifluoromethyl)phenyl]-](/api/spectrum/3BllZ4MApfE/structure.png?h=300&w=458 "acetamide, 2-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)thio]-N-[3-(trifluoromethyl)phenyl]-")
