SpectraBase Spectrum ID |
A95JEqzGBE7 |
Name |
3-{[(2,6-Dimethylpyrimidin-4-yl)amino]methylene}-2-hydroxy-2-(trifluoromethyl)chroman-4-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H14F3N3O3 |
InChI |
InChI=1S/C17H14F3N3O3/c1-9-7-14(23-10(2)22-9)21-8-12-15(24)11-5-3-4-6-13(11)26-16(12,25)17(18,19)20/h3-8,25H,1-2H3,(H,21,22,23)/b12-8- |
InChIKey |
QWDJJJLMVXHFSA-WQLSENKSSA-N |
Molecular Weight |
365.312 g/mol |
SMILES |
OC1(\C(=C/Nc2nc(C)nc(c2)C)C(c2c(O1)cccc2)=O)C(F)(F)F |
SPLASH |
splash10-006t-2951000000-41408229d5ac4a3152f9 |
Source of Spectrum |
F4-41-3873-3l |
Wiley ID |
1673129 |