Try beta.chemspider
- 2 of 2 defined stereocentres
{(2S,4R)-4-[(4-Methoxyphenyl)sulfanyl]-1-[2-(trifluoromethyl)benzyl]-2-pyrrolidinyl}(4-methyl-1,4-diazepan-1-yl)methanone
CN1CCCN(CC1)C(=O)[C@@H]2C[C@H](CN2Cc3ccccc3C(F)(F)F)Sc4ccc(cc4)OC
InChI=1S/C26H32F3N3O2S/c1-30-12-5-13-31(15-14-30)25(33)24-16-22(35-21-10-8-20(34-2)9-11-21)18-32(24)17-19-6-3-4-7-23(19)26(27,28)29/h3-4,6-11,22,24H,5,12-18H2,1-2H3/t22-,24+/m1/s1
DLRSAAFQPMDAQZ-VWNXMTODSA-N
CSID:22836769, http://www.chemspider.com/Chemical-Structure.22836769.html (accessed 14:43, 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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