| SpectraBase Spectrum ID |
H2OorgS8QZe |
| Name |
2-(4-Methylphenyl)-8-oxo-4-phenyl-7,8,9,10-tetrahydro[1,2,4]triazolo[1,5-a:4,3-a']dipyrimidin-5-ium chloride |
| Alternate Name(s) |
8-Oxo-4-phenyl-2-(p-tolyl)-7,8,9,10-tetrahydro-[1,2,4]triazolo[1,5-a:4,3-a']dipyrimidin-5-ium chloride |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H18ClN5O |
| InChI |
InChI=1S/C21H17N5O.ClH/c1-14-7-9-15(10-8-14)17-13-18(16-5-3-2-4-6-16)26-21(22-17)25-12-11-19(27)23-20(25)24-26;/h2-10,13H,11-12H2,1H3;1H |
| InChIKey |
OJNNQFNNXKAIGO-UHFFFAOYSA-N |
| Molecular Weight |
391.862 g/mol |
| SMILES |
[Cl-].N1C(CC[n]2c3[n+](nc12)c(cc(n3)-c1ccc(C)cc1)-c1ccccc1)=O |
| SPLASH |
splash10-052r-9018000000-4bb987c39427cc25ac29 |
| Source of Spectrum |
J-70-696-9d |
| Wiley ID |
1742567 |
![2-(4-Methylphenyl)-8-oxo-4-phenyl-7,8,9,10-tetrahydro[1,2,4]triazolo[1,5-a:4,3-a']dipyrimidin-5-ium chloride](/api/spectrum/H2OorgS8QZe/structure.png?h=300&w=458 "2-(4-Methylphenyl)-8-oxo-4-phenyl-7,8,9,10-tetrahydro[1,2,4]triazolo[1,5-a:4,3-a']dipyrimidin-5-ium chloride")
