| SpectraBase Spectrum ID |
9eVXTJBoEX8 |
| Name |
(5-benzoyl-3-cyano-4-naphthalen-1-yl-6-trifluoromethyl-pyridin-2-ylsulfanyl)-acetic acid benzyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C33H21F3N2O3S |
| InChI |
InChI=1S/C33H21F3N2O3S/c34-33(35,36)31-29(30(40)23-13-5-2-6-14-23)28(25-17-9-15-22-12-7-8-16-24(22)25)26(18-37)32(38-31)42-20-27(39)41-19-21-10-3-1-4-11-21/h1-17H,19-20H2 |
| InChIKey |
UBTDARACTWPENV-UHFFFAOYSA-N |
| Molecular Weight |
582.597 g/mol |
| SMILES |
c1(c(nc(c(c1-c1c2c(cccc2)ccc1)C#N)SCC(=O)OCc1ccccc1)C(F)(F)F)C(=O)c1ccccc1 |
| SPLASH |
splash10-0f7c-6139600000-20cdd9806f2ff2ef4b59 |
| Synonyms |
Benzyl {[5-benzoyl-3-cyano-4-(1-naphthyl)-6-(trifluoromethyl)-2-pyridinyl]sulfanyl}acetate |
| Wiley ID |
1455247 |
