Methanol → HCID 66743241, compound
Reaction equation
[BH4-:50].[CH3:48][OH:49].[Cl:52][CH2:53][Cl:54].[F:1][c:2]1[cH:3][c:4]([C:43]([C:44]#[N:45])([CH3:46])[CH3:47])[cH:5][c:6]2[cH:7][cH:8][n:9](-[c:13]3[c:14]([CH:41]=[O:42])[c:15](-[c:19]4[n:20][n:21]([CH3:40])[c:22](=[O:39])[c:23]([NH:25][c:26]5[n:27][n:28]6[c:29]([cH:38]5)[CH2:30][N:31]([CH:34]5[CH2:35][O:36][CH2:37]5)[CH2:32][CH2:33]6)[cH:24]4)[cH:16][cH:17][cH:18]3)[c:10](=[O:12])[c:11]12.[Na+:51]>>[F:1][c:2]1[cH:3][c:4]([C:43]([C:44]#[N:45])([CH3:46])[CH3:47])[cH:5][c:6]2[cH:7][cH:8][n:9](-[c:13]3[c:14]([CH2:41][OH:42])[c:15](-[c:19]4[n:20][n:21]([CH3:40])[c:22](=[O:39])[c:23]([NH:25][c:26]5[n:27][n:28]6[c:29]([cH:38]5)[CH2:30][N:31]([CH:34]5[CH2:35][O:36][CH2:37]5)[CH2:32][CH2:33]6)[cH:24]4)[cH:16][cH:17][cH:18]3)[c:10](=[O:12])[c:11]12Participants
6
Sources & evidence
- ORD record
- ord-528d90925cc2450c95e8a5073d6bcc12
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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