Ethanol → 2-(1-(3-ethoxy-phenyl)-3-methyl-but-1-enyl)-1H-pyrrolo[2,3-b]pyridine
Reaction equation
[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][c:6]([C:10](=[CH:11][CH:12]([CH3:13])[CH3:14])[c:15]2[cH:16][c:17]3[c:18]([n:19][cH:20][cH:21][cH:22]3)[n:23]2[S:24]([c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)(=[O:31])=[O:32])[cH:7][cH:8][cH:9]1.[CH3:35][CH2:36][OH:37].[Na+:34].[O:38]1[CH2:39][CH2:40][CH2:41][CH2:42]1.[OH-:33].[OH2:43]>>[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][c:6]([C:10](=[CH:11][CH:12]([CH3:13])[CH3:14])[c:15]2[cH:16][c:17]3[c:18]([n:19][cH:20][cH:21][cH:22]3)[nH:23]2)[cH:7][cH:8][cH:9]1Participants
7
Sources & evidence
- ORD record
- ord-d6d0f234ed7348a8830b7f2ab934f286
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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