| SpectraBase Spectrum ID |
G9sfy3jsHDS |
| Name |
N(6)-Benzoyl-9-(trans-2',2'-dioxoperhydrocyclopenta[c]thiin-6'-yl)-9H-adenine |
| Alternate Name(s) |
N-{9-[(4aR,7aS)-2,2-dioxidooctahydrocyclopenta[c]thiopyran-6-yl]-9H-purin-6-yl}benzamide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H21N5O3S |
| InChI |
InChI=1S/C20H21N5O3S/c26-20(13-4-2-1-3-5-13)24-18-17-19(22-11-21-18)25(12-23-17)16-8-14-6-7-29(27,28)10-15(14)9-16/h1-5,11-12,14-16H,6-10H2,(H,21,22,24,26)/t14-,15+,16?/m0/s1 |
| InChIKey |
FFDYLCASGJCQRB-QMRHZFGWSA-N |
| Molecular Weight |
411.480 g/mol |
| SMILES |
N(c1c2c([n](cn2)C2C[C@@]3(CS(=O)(=O)CC[C@]3(C2)[H])[H])ncn1)C(=O)c1ccccc1 |
| SPLASH |
splash10-067i-9113000000-013975edb545606534d8 |
| Source of Spectrum |
H-76-258-24 |
| Wiley ID |
1374048 |
![N(6)-Benzoyl-9-(trans-2',2'-dioxoperhydrocyclopenta[c]thiin-6'-yl)-9H-adenine](/api/spectrum/G9sfy3jsHDS/structure.png?h=300&w=458 "N(6)-Benzoyl-9-(trans-2',2'-dioxoperhydrocyclopenta[c]thiin-6'-yl)-9H-adenine")
