Try beta.chemspider
- 2 of 2 defined stereocentres
{(2S,4R)-4-[(4-Methoxyphenyl)sulfanyl]-1-[4-(trifluoromethyl)benzyl]-2-pyrrolidinyl}(4-methyl-1,4-diazepan-1-yl)methanone
CN1CCCN(CC1)C(=O)[C@@H]2C[C@H](CN2Cc3ccc(cc3)C(F)(F)F)Sc4ccc(cc4)OC
InChI=1S/C26H32F3N3O2S/c1-30-12-3-13-31(15-14-30)25(33)24-16-23(35-22-10-8-21(34-2)9-11-22)18-32(24)17-19-4-6-20(7-5-19)26(27,28)29/h4-11,23-24H,3,12-18H2,1-2H3/t23-,24+/m1/s1
CFHJTZWHDAWFRR-RPWUZVMVSA-N
CSID:23039673, http://www.chemspider.com/Chemical-Structure.23039673.html (accessed 15:51, Jun 5, 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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