Chloride → 4-(+/-)-(5-Amino-2,4,6,7-tetramethyldihydrobenzofuran-2-ylmethyl)-1-(4-imidazol-1-ylphenyl)piperazine
Reaction equation
[CH3:42][CH2:43][OH:44].[Cl-:37].[ClH:38].[N+:1]([O-:2])(=[O:3])[C:4]1=[C:5]([CH3:34])[C:6]([CH3:33])=[C:7]2[CH:8]([CH2:9][C:10]([CH3:12])([CH2:13][N:14]3[CH2:15][CH2:16][N:17]([c:20]4[cH:21][cH:22][c:23](-[n:26]5[cH:27][n:28][cH:29][cH:30]5)[cH:24][cH:25]4)[CH2:18][CH2:19]3)[O:11]2)[CH:31]1[CH3:32].[Na+:40].[OH-:39].[OH2:35].[OH2:36].[OH2:41]>>[NH2:1][C:4]1=[C:5]([CH3:34])[C:6]([CH3:33])=[C:7]2[CH:8]([CH2:9][C:10]([CH3:12])([CH2:13][N:14]3[CH2:15][CH2:16][N:17]([c:20]4[cH:21][cH:22][c:23](-[n:26]5[cH:27][n:28][cH:29][cH:30]5)[cH:24][cH:25]4)[CH2:18][CH2:19]3)[O:11]2)[CH:31]1[CH3:32]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-84cbaae130344f70a4701bd4d17b37dc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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