| SpectraBase Spectrum ID |
1HQFL11Rp48 |
| Name |
N-(2,6-Dichloro-phenyl)-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-A]azepin-3-ylsulfanyl)-acetamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
370.042187724 u |
| Formula |
C15H16Cl2N4OS |
| InChI |
InChI=1S/C15H16Cl2N4OS/c16-10-5-4-6-11(17)14(10)18-13(22)9-23-15-20-19-12-7-2-1-3-8-21(12)15/h4-6H,1-3,7-9H2,(H,18,22) |
| InChIKey |
WIJJXJZDQZMADX-UHFFFAOYSA-N |
| Molecular Weight |
371.286 g/mol |
| SMILES |
C1CCN2C(=NN=C2CC1)SCC(NC1=C(C=CC=C1Cl)Cl)=O |
![N-(2,6-Dichloro-phenyl)-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylsulfanyl)-acetamide](/api/spectrum/1HQFL11Rp48/structure.png?h=300&w=458 "N-(2,6-Dichloro-phenyl)-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylsulfanyl)-acetamide")
