| SpectraBase Spectrum ID |
4dVFyN2Pz0s |
| Name |
5-[4-((2R,3R)-2-Octyl-1,1-dioxo-1lambda*6*-thietan-3-yloxy)-phenyl]-2-octyloxy-pyrimidine |
| Alternate Name(s) |
(2R,3S)-3-Octyl-3-{[(2'-octyloxypyrimidin-5'-yl)phenyl]oxymethyl}thiirane-1,1-dioxide
(2R,3S)-3-Octyl-3-{[(2'-octyloxypyrimidin-5'-yl)phenyl]oxy}Thietane-1,1-dioxide
5-(4-{[(2R,3R)-2-octyl-1,1-dioxidothietanyl]oxy}phenyl)-2-(octyloxy)pyrimidine |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H44N2O4S |
| InChI |
InChI=1S/C29H44N2O4S/c1-3-5-7-9-11-13-15-28-27(23-36(28,32)33)35-26-18-16-24(17-19-26)25-21-30-29(31-22-25)34-20-14-12-10-8-6-4-2/h16-19,21-22,27-28H,3-15,20,23H2,1-2H3/t27-,28-/m1/s1 |
| InChIKey |
ADQCKLJZTVYQRJ-VSGBNLITSA-N |
| Molecular Weight |
516.741 g/mol |
| SMILES |
C1S([C@@]([C@@]1(Oc1ccc(-c2cnc(nc2)OCCCCCCCC)cc1)[H])(CCCCCCCC)[H])(=O)=O |
| SPLASH |
splash10-0wmr-4951620000-fcab5bbf11722813a9a2 |
| Source of Spectrum |
SK-25-2671-9 |
| Wiley ID |
866876 |
![5-[4-((2R,3R)-2-Octyl-1,1-dioxo-1lambda*6*-thietan-3-yloxy)-phenyl]-2-octyloxy-pyrimidine](/api/spectrum/4dVFyN2Pz0s/structure.png?h=300&w=458 "5-[4-((2R,3R)-2-Octyl-1,1-dioxo-1lambda*6*-thietan-3-yloxy)-phenyl]-2-octyloxy-pyrimidine")
