Try beta.chemspider
- 5 of 6 defined stereocentres
(1R,2R,3R,5S)-3-[7-{[(1R)-2-(3,4-Difluorophenyl)cyclopropyl]amino}-5-(propylsulfanyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-3-yl]-5-(2-hydroxyethoxy)-1,2-cyclopentanediol
CCCSC1N=C(N[C@@H]2CC2C2C=C(F)C(F)=CC=2)C2N=NN([C@@H]3C[C@H](OCCO)[C@H](O)[C@@H]3O)C=2N=1
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+/m1/s1
OEKWJQXRCDYSHL-OJEHXVOYSA-N
CSID:78315689, http://www.chemspider.com/Chemical-Structure.78315689.html (accessed 12:45, Apr 23, 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
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