Methanol → HCID 178449855, compound
Reaction equation
[CH2:40]([P:41]([CH2:42][CH2:43][CH2:44][CH3:45])([CH2:46][CH2:47][CH2:48][CH3:49])=[CH:50][C:51]#[N:52])[CH2:53][CH2:54][CH3:55].[CH3:56][OH:57].[CH3:58][c:59]1[cH:60][cH:61][cH:62][cH:63][cH:64]1.[Cl:1][c:2]1[cH:3][c:4]([CH:8]2[CH2:9][C:10]([CH3:34])([CH2:35][C:36](=[O:37])[O:38][CH3:39])[C:11](=[O:33])[N:12]([CH:21]([CH2:22][NH:23][S:24](=[O:25])(=[O:26])[C:27]3([CH3:30])[CH2:28][CH2:29]3)[CH2:31][CH3:32])[CH:13]2[c:14]2[cH:15][cH:16][c:17]([Cl:20])[cH:18][cH:19]2)[cH:5][cH:6][cH:7]1>>[Cl:1][c:2]1[cH:3][c:4]([CH:8]2[CH2:9][C:10]([CH3:34])([CH2:35][C:36](=[O:37])[O:38][CH3:39])[C:11](=[O:33])[N:12]([CH:21]([CH2:22][N:23]([S:24](=[O:25])(=[O:26])[C:27]3([CH3:30])[CH2:28][CH2:29]3)[CH3:40])[CH2:31][CH3:32])[CH:13]2[c:14]2[cH:15][cH:16][c:17]([Cl:20])[cH:18][cH:19]2)[cH:5][cH:6][cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-5eaf4bea108d41c5a2ba4d1a27221651
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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