Try beta.chemspider
- 2 of 2 defined stereocentres
- Non-standard isotope
1-(4-{[(2R,4S)-2-(2,4-Dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)-4-isopropyl(~2~H_8_)piperazine
CC(C)N1C([2H])([2H])C([2H])([2H])N(C([2H])([2H])C1([2H])[2H])C2=CC=C(C=C2)OC[C@H]3CO[C@](CN4C=NC=N4)(C5=C(C=C(C=C5)Cl)Cl)O3 [2H]C1(C(N(C(C(N1c2ccc(cc2)OC[C@H]3CO[C@](O3)(Cn4cncn4)c5ccc(cc5Cl)Cl)([2H])[2H])([2H])[2H])C(C)C)([2H])[2H])[2H]
InChI=1S/C26H31Cl2N5O3/c1-19(2)31-9-11-32(12-10-31)21-4-6-22(7-5-21)34-14-23-15-35-26(36-23,16-33-18-29-17-30-33)24-8-3-20(27)13-25(24)28/h3-8,13,17-19,23H,9-12,14-16H2,1-2H3/t23-,26-/m0/s1/i9D2,10D2,11D2,12D2
BLSQLHNBWJLIBQ-DZENQRFUSA-N
CSID:58785358, http://www.chemspider.com/Chemical-Structure.58785358.html (accessed 20:11, Apr 30, 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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