| SpectraBase Spectrum ID |
Ik9iJ4WgHlK |
| Name |
3-[2-Amino-5-(4-methylphenyl)-7-phenyl-4,5,6,7-tetrahydro-3H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium-3-yl]propanoate |
| Alternate Name(s) |
3-(2-amino-7-phenyl-5-(p-tolyl)-4,5,6,7-tetrahydro-3H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium-3-yl)propanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H23N5O2 |
| InChI |
InChI=1S/C21H23N5O2/c1-14-7-9-15(10-8-14)17-13-18(16-5-3-2-4-6-16)26-21(23-17)25(20(22)24-26)12-11-19(27)28/h2-10,17-18H,11-13H2,1H3,(H3,22,24,27,28) |
| InChIKey |
CJGGLVCJJRQBSA-UHFFFAOYSA-N |
| Molecular Weight |
377.448 g/mol |
| SMILES |
Nc1n[n+]2c([n]1CCC([O-])=O)NC(CC2c1ccccc1)c1ccc(cc1)C |
| SPLASH |
splash10-0a4i-1309000000-3577f46f503bedc6abb8 |
| Source of Spectrum |
F-70-699-17 |
| Wiley ID |
1742552 |
![3-[2-Amino-5-(4-methylphenyl)-7-phenyl-4,5,6,7-tetrahydro-3H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium-3-yl]propanoate](/api/spectrum/Ik9iJ4WgHlK/structure.png?h=300&w=458 "3-[2-Amino-5-(4-methylphenyl)-7-phenyl-4,5,6,7-tetrahydro-3H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium-3-yl]propanoate")
