Methanol → HCID 22180281, compound
Reaction equation
[CH2:1]([CH:2]=[CH2:3])[N:4]([C:5]([c:6]1[cH:7][n:8][c:9]([N:12]2[CH2:13][CH2:14][N:15]([CH2:18][CH2:19][CH2:20][CH2:21][C:22]3([C:35]([NH:36][CH2:37][C:38]([F:39])([F:40])[F:41])=[O:42])[c:23]4[cH:24][cH:25][cH:26][cH:27][c:28]4-[c:29]4[cH:30][cH:31][cH:32][cH:33][c:34]43)[CH2:16][CH2:17]2)[cH:10][cH:11]1)=[O:43])[CH:44]1[CH2:45][CH2:46][CH2:47][CH2:48][CH2:49]1.[CH2:52]([Cl:53])[Cl:54].[CH3:50][OH:51]>>[CH2:1]([CH2:2][CH3:3])[N:4]([C:5]([c:6]1[cH:7][n:8][c:9]([N:12]2[CH2:13][CH2:14][N:15]([CH2:18][CH2:19][CH2:20][CH2:21][C:22]3([C:35]([NH:36][CH2:37][C:38]([F:39])([F:40])[F:41])=[O:42])[c:23]4[cH:24][cH:25][cH:26][cH:27][c:28]4-[c:29]4[cH:30][cH:31][cH:32][cH:33][c:34]43)[CH2:16][CH2:17]2)[cH:10][cH:11]1)=[O:43])[CH:44]1[CH2:45][CH2:46][CH2:47][CH2:48][CH2:49]1Participants
4
Sources & evidence
- ORD record
- ord-be75f942fe434762bc064a8fabe0b2a6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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