| SpectraBase Spectrum ID |
2ccawxZu84o |
| Name |
N-((1R*,5R*,8R*)-8-Chloro-5-(phenylethynyl)-7-(thiophen-3-yl)bicyclo[3.2.1]oct-6-en-6-yl)-4-methylbenzenesulfonamide |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H24ClNO2S2 |
| InChI |
InChI=1S/C27H24ClNO2S2/c1-19-9-11-22(12-10-19)33(30,31)29-26-24(21-14-17-32-18-21)23-8-5-15-27(26,25(23)28)16-13-20-6-3-2-4-7-20/h2-4,6-7,9-12,14,17-18,23,25,29H,5,8,15H2,1H3/t23-,25+,27+/m1/s1 |
| InChIKey |
QMCHILKERPOMRM-HYZYYIOASA-N |
| Literature Reference DOI |
10.1002/adsc.201801469 |
| Molecular Weight |
494.067 g/mol |
| SMILES |
N(C1=C([C@@]2([C@@]([C@]1(CCC2)C#Cc1ccccc1)(Cl)[H])[H])c1cscc1)S(c1ccc(cc1)C)(=O)=O |
| SPLASH |
splash10-000x-0609500000-16a61c1f4ea451b16d19 |
| Source of Spectrum |
ASC-361-SM37-2k |
| Synonyms |
N-((1R,5R,8R)-8-chloro-5-(phenylethynyl)-7-(thiophen-3-yl)bicyclo[3.2.1]oct-6-en-6-yl)-4-methylbenzenesulfonamide |
| Wiley ID |
1813973 |
![N-((1R*,5R*,8R*)-8-Chloro-5-(phenylethynyl)-7-(thiophen-3-yl)bicyclo[3.2.1]oct-6-en-6-yl)-4-methylbenzenesulfonamide](/api/spectrum/2ccawxZu84o/structure.png?h=300&w=458 "N-((1R*,5R*,8R*)-8-Chloro-5-(phenylethynyl)-7-(thiophen-3-yl)bicyclo[3.2.1]oct-6-en-6-yl)-4-methylbenzenesulfonamide")
