Try beta.chemspider
- 2 of 2 defined stereocentres
1-[(4a'S,8a'R)-2'-(4-Fluorophenyl)-4a',5',6',7',8',8a'-hexahydro-4'H-spiro[cyclohexane-1,9'-[1,2,4]triazolo[5,1-b]quinazolin]-4'-yl]-1-pentanone
CCCCC(=O)N1c2nc(nn2C3(CCCCC3)[C@H]4[C@@H]1CCCC4)c5ccc(cc5)F
InChI=1S/C25H33FN4O/c1-2-3-11-22(31)29-21-10-6-5-9-20(21)25(16-7-4-8-17-25)30-24(29)27-23(28-30)18-12-14-19(26)15-13-18/h12-15,20-21H,2-11,16-17H2,1H3/t20-,21+/m1/s1
IGTJCENZCGFWQH-RTWAWAEBSA-N
CSID:22953981, http://www.chemspider.com/Chemical-Structure.22953981.html (accessed 18:44, May 21, 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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