Methanol → 4-({2-[2-(2-Amino-ethyl)-1-benzhydryl-5-chloro-1H-indol-3-yl]-ethyl}methyl-amino)-benzoic acid methyl ester
Reaction equation
[CH3:1][O:2][C:3]([c:4]1[cH:5][cH:6][c:7]([N:10]([CH3:11])[CH2:12][CH2:13][c:14]2[c:15]([CH2:37][CH2:38][N:39]=[N+:40]=[N-:41])[n:16]([CH:24]([c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[c:31]3[cH:32][cH:33][cH:34][cH:35][cH:36]3)[c:17]3[cH:18][cH:19][c:20]([Cl:23])[cH:21][c:22]23)[cH:8][cH:9]1)=[O:42].[CH3:46][OH:47].[Cl:43][CH2:44][Cl:45]>>[CH3:1][O:2][C:3]([c:4]1[cH:5][cH:6][c:7]([N:10]([CH3:11])[CH2:12][CH2:13][c:14]2[c:15]([CH2:37][CH2:38][NH2:39])[n:16]([CH:24]([c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[c:31]3[cH:32][cH:33][cH:34][cH:35][cH:36]3)[c:17]3[cH:18][cH:19][c:20]([Cl:23])[cH:21][c:22]23)[cH:8][cH:9]1)=[O:42]Participants
4
Sources & evidence
- ORD record
- ord-3195762f03b441a290825a097472d2c1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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