| SpectraBase Spectrum ID |
1KHdr8cPRY |
| Name |
{3-(4-(Methoxyphenyl)-5-[4-(pyrrolidin-1-yl)isoxazol-4-yl}(thiophene-2-yl)methanone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H22N2O3S |
| InChI |
InChI=1S/C25H22N2O3S/c1-29-20-12-8-17(9-13-20)23-22(24(28)21-5-4-16-31-21)25(30-26-23)18-6-10-19(11-7-18)27-14-2-3-15-27/h4-13,16H,2-3,14-15H2,1H3 |
| InChIKey |
RNEPDVXXKSTBGW-UHFFFAOYSA-N |
| Molecular Weight |
430.522 g/mol |
| SMILES |
c1(c(onc1-c1ccc(cc1)OC)-c1ccc(N2CCCC2)cc1)C(c1sccc1)=O |
| SPLASH |
splash10-01p6-6925400000-0a6ef7640bf59250d0f9 |
| Source of Spectrum |
F4-40-300-5m |
| Wiley ID |
1670204 |
