Try beta.chemspider
- 6 of 6 defined stereocentres
- Non-standard isotope
(1S,2S,3R,5S)-3-(7-{[(1R,2S)-2-(3,4-Difluorophenyl)cyclopropyl]amino}-5-[(~2~H_7_)propylsulfanyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-3-yl)-5-(2-hydroxyethoxy)-1,2-cyclopentanediol
[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])Sc1nc(c2c(n1)n(nn2)[C@@H]3C[C@@H]([C@H]([C@H]3O)O)OCCO)N[C@@H]4C[C@H]4c5ccc(c(c5)F)F
InChI=1S/C23H28F2N6O4S/c1-2-7-36-23-27-21(26-15-9-12(15)11-3-4-13(24)14(25)8-11)18-22(28-23)31(30-29-18)16-10-17(35-6-5-32)20(34)19(16)33/h3-4,8,12,15-17,19-20,32-34H,2,5-7,9-10H2,1H3,(H,26,27,28)/t12-,15+,16+,17-,19-,20+/m0/s1/i1D3,2D2,7D2
OEKWJQXRCDYSHL-MHTCSOGVSA-N
CSID:48062359, http://www.chemspider.com/Chemical-Structure.48062359.html (accessed 23:51, May 2, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
Advertisement
Spotlight