| SpectraBase Spectrum ID |
IZDAu4hVd5i |
| Name |
Methyl 8-Isopropyl-2-phenyl-4-{[(trifluoromethyl)sulfonyl]oxy}-5,8,9,10-tetrahydropyrimido[4,5-d]-azocine-6-carboxylate |
| Alternate Name(s) |
(E)-methyl 8-isopropyl-2-phenyl-4-(((trifluoromethyl)sulfonyl)oxy)-5,8,9,10-tetrahydropyrimido[4,5-d]azocine-6-carboxylate
(6E)-2-phenyl-8-propan-2-yl-4-(trifluoromethylsulfonyloxy)-9,10-dihydro-5H-pyrimido[4,5-d]azocine-6-carboxylic acid methyl ester
Methyl (6E)-8-isopropyl-2-phenyl-4-(trifluoromethylsulfonyloxy)-9,10-dihydro-5H-pyrimido[4,5-d]azocine-6-carboxylate
Methyl (6E)-2-phenyl-8-propan-2-yl-4-(trifluoromethylsulfonyloxy)-9,10-dihydro-5H-pyrimido[4,5-d]azocine-6-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H22F3N3O5S |
| InChI |
InChI=1S/C21H22F3N3O5S/c1-13(2)27-10-9-17-16(11-15(12-27)20(28)31-3)19(32-33(29,30)21(22,23)24)26-18(25-17)14-7-5-4-6-8-14/h4-8,12-13H,9-11H2,1-3H3/b15-12+ |
| InChIKey |
ITCXDGQCOQPWAE-NTCAYCPXSA-N |
| Molecular Weight |
485.478 g/mol |
| SMILES |
c1(OS(C(F)(F)F)(=O)=O)c2C\C(=C/N(CCc2nc(n1)-c1ccccc1)C(C)C)C(=O)OC |
| SPLASH |
splash10-00di-0013900000-24603d34e406aaa2a4ec |
| Source of Spectrum |
HC-49-1183-10 |
| Wiley ID |
1739253 |
![Methyl 8-Isopropyl-2-phenyl-4-{[(trifluoromethyl)sulfonyl]oxy}-5,8,9,10-tetrahydropyrimido[4,5-d]-azocine-6-carboxylate](/api/spectrum/IZDAu4hVd5i/structure.png?h=300&w=458 "Methyl 8-Isopropyl-2-phenyl-4-{[(trifluoromethyl)sulfonyl]oxy}-5,8,9,10-tetrahydropyrimido[4,5-d]-azocine-6-carboxylate")
