Ethanol → 4-(2,5-Dimethyl-1H-indol-4-yl)-1-(9-naphthalen-2-yl-7,9-diaza-bicyclo[4.2.2]dec-3-en-7-yl)-butan-2-ol
Reaction equation
[CH3:1][c:2]1[nH:3][c:4]2[cH:5][cH:6][c:7]([CH3:16])[c:8]([CH2:11][CH2:12][CH:13]3[O:14][CH2:15]3)[c:9]2[cH:10]1.[CH3:46][CH2:47][OH:48].[CH:37]([N:38]([CH2:39][CH3:40])[CH:41]([CH3:42])[CH3:43])([CH3:44])[CH3:45].[cH:17]1[c:18]([N:27]2[CH:28]3[CH2:29][CH:30]=[CH:31][CH2:32][CH:33]([CH2:34]2)[NH:35][CH2:36]3)[cH:19][cH:20][c:21]2[cH:22][cH:23][cH:24][cH:25][c:26]12>>[CH3:1][c:2]1[nH:3][c:4]2[cH:5][cH:6][c:7]([CH3:16])[c:8]([CH2:11][CH2:12][CH:13]([OH:14])[CH2:15][N:35]3[CH:33]4[CH2:32][CH:31]=[CH:30][CH2:29][CH:28]([N:27]([c:18]5[cH:17][c:26]6[c:21]([cH:20][cH:19]5)[cH:22][cH:23][cH:24][cH:25]6)[CH2:34]4)[CH2:36]3)[c:9]2[cH:10]1Participants
5
Sources & evidence
- ORD record
- ord-fad1c0bfdae6448d82688361763f864d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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