| SpectraBase Spectrum ID |
JaBE8AGv71f |
| Name |
2,4-Dichloro-N-[7-(4-chlorophenyl)-5-oxo-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-A]pyrimidin-2-yl]benzamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
435.005657744 u |
| Formula |
C18H12Cl3N5O2 |
| InChI |
InChI=1S/C18H12Cl3N5O2/c19-10-3-1-9(2-4-10)14-8-15(27)22-18-24-17(25-26(14)18)23-16(28)12-6-5-11(20)7-13(12)21/h1-7,14H,8H2,(H2,22,23,24,25,27,28) |
| InChIKey |
XQMHZDSNHJQEEW-UHFFFAOYSA-N |
| Molecular Weight |
436.686 g/mol |
| SMILES |
N(C1=NN2C(=N1)NC(CC2C=1C=CC(=CC1)Cl)=O)C(C1=C(C=C(C=C1)Cl)Cl)=O |
![2,4-dichloro-N-[7-(4-chlorophenyl)-5-oxo-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzamide](/api/spectrum/JaBE8AGv71f/structure.png?h=300&w=458 "2,4-dichloro-N-[7-(4-chlorophenyl)-5-oxo-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzamide")
