1,2-Dichloroethane → 4-Fluoro-3-[cis-4-[4-(1H-indol-4-yl)-1-piperazinyl]-cyclohexyl]-1H-indole
Reaction equation
[C:33]([O:34][BH-:35]([O:36][C:37](=[O:38])[CH3:39])[O:40][C:41](=[O:42])[CH3:43])(=[O:44])[CH3:45].[CH3:47][C:48](=[O:49])[OH:50].[Cl:51][CH2:52][CH2:53][Cl:54].[F:1][c:2]1[c:3]2[c:4]([CH:11]3[CH2:12][CH2:13][C:14](=[O:17])[CH2:15][CH2:16]3)[cH:5][nH:6][c:7]2[cH:8][cH:9][cH:10]1.[Na+:46].[nH:18]1[cH:19][cH:20][c:21]2[c:22]([N:27]3[CH2:28][CH2:29][NH:30][CH2:31][CH2:32]3)[cH:23][cH:24][cH:25][c:26]12>>[F:1][c:2]1[c:3]2[c:4]([CH:11]3[CH2:12][CH2:13][CH:14]([N:30]4[CH2:29][CH2:28][N:27]([c:22]5[c:21]6[cH:20][cH:19][nH:18][c:26]6[cH:25][cH:24][cH:23]5)[CH2:32][CH2:31]4)[CH2:15][CH2:16]3)[cH:5][nH:6][c:7]2[cH:8][cH:9][cH:10]1Participants
7
Sources & evidence
- ORD record
- ord-831e5dcf586c4b5aa8aa1bba39779e1b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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