Sodium ion → 4-Tert-butyl-2-{5-[3-(3-cyano-6-methylindole-1-yl)propyl]-benzofuran-2-yl}thiazole
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][c:7](-[c:10]2[o:11][c:12]3[c:13]([cH:14]2)[cH:15][c:16]([CH2:19][CH2:20][CH2:21][Cl:22])[cH:17][cH:18]3)[s:8][cH:9]1.[C:23](#[N:24])[c:25]1[cH:26][nH:27][c:28]2[cH:29][c:30]([CH3:34])[cH:31][cH:32][c:33]12.[Na+:36].[O:37]1[CH2:38][CH2:39][CH2:40][CH2:41]1.[OH-:35]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][c:7](-[c:10]2[o:11][c:12]3[c:13]([cH:14]2)[cH:15][c:16]([CH2:19][CH2:20][CH2:21][n:27]2[cH:26][c:25]([C:23]#[N:24])[c:33]4[c:28]2[cH:29][c:30]([CH3:34])[cH:31][cH:32]4)[cH:17][cH:18]3)[s:8][cH:9]1Participants
6
Sources & evidence
- ORD record
- ord-cafbaa2680ad4b2ebc61bd5ad5dcef12
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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