| SpectraBase Spectrum ID |
JnLvTH73Yxw |
| Name |
N-[3-Chloranyl-5-(trifluoromethyl)pyridin-2-yl]-2-(5H-[1,2,4]triazino[5,6-B]indol-3-ylsulfanyl)ethanamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
438.027742328 u |
| Formula |
C17H10ClF3N6OS |
| InChI |
InChI=1S/C17H10ClF3N6OS/c18-10-5-8(17(19,20)21)6-22-14(10)24-12(28)7-29-16-25-15-13(26-27-16)9-3-1-2-4-11(9)23-15/h1-6H,7H2,(H,22,24,28)(H,23,25,27) |
| InChIKey |
XRAGZHGFJAYAGR-UHFFFAOYSA-N |
| Molecular Weight |
438.816 g/mol |
| SMILES |
C12=C(N=NC(=N2)SCC(NC2=NC=C(C(F)(F)F)C=C2Cl)=O)C=2C=CC=CC2N1 |
![N-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)ethanamide](/api/spectrum/JnLvTH73Yxw/structure.png?h=300&w=458 "N-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)ethanamide")
