SpectraBase Spectrum ID |
35O2YhaWbcN |
Name |
7-(4-Fluorophenyl)-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C25H18F7N5O2 |
InChI |
InChI=1S/C25H18F7N5O2/c1-12-15(16-4-2-3-5-17(16)33-12)10-11-37-20-18(21(38)35-22(37)39)23(24(27,28)29,25(30,31)32)36-19(34-20)13-6-8-14(26)9-7-13/h2-9,33H,10-11H2,1H3,(H,34,36)(H,35,38,39) |
InChIKey |
NIHQEBJZCKVZOH-UHFFFAOYSA-N |
Molecular Weight |
553.441 g/mol |
SMILES |
[nH]1c2c(c(CCN3C(NC(C4=C3NC(=NC4(C(F)(F)F)C(F)(F)F)c3ccc(cc3)F)=O)=O)c1C)cccc2 |
SPLASH |
splash10-0a4l-1900000000-bf87371e3900915f904c |
Source of Spectrum |
AD-0-2532-0 |
Synonyms |
7-(4-fluorophenyl)-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione
7-(4-fluorophenyl)-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-quinone |
Wiley ID |
1435992 |