| SpectraBase Spectrum ID |
HF5S095xoY2 |
| Name |
2-Benzoyl-3-(3,4,5-trimethoxyphenyl)-3-(2,4,6-triaminopyrimidin-5-yl)-propionitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H24N6O4 |
| InChI |
InChI=1S/C23H24N6O4/c1-31-15-9-13(10-16(32-2)20(15)33-3)17(18-21(25)28-23(27)29-22(18)26)14(11-24)19(30)12-7-5-4-6-8-12/h4-10,14,17H,1-3H3,(H6,25,26,27,28,29) |
| InChIKey |
CBQLCYDZCBXSBH-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1002/ardp.19893220509 |
| Molecular Weight |
448.483 g/mol |
| SMILES |
Nc1nc(nc(c1C(C(C#N)C(c1ccccc1)=O)c1cc(c(c(c1)OC)OC)OC)N)N |
| SPLASH |
splash10-08i0-4894100000-ffa8cc4ef68ce75ee812 |
| Source of Spectrum |
APC-322-289-17Ac |
| Synonyms |
2-Benzoyl-3-(2,4,6-triaminopyrimidin-5-yl)-3-(3,4,5-trimethoxyphenyl)propanenitrile |
| Wiley ID |
1788585 |
