Methanol → HCID 67158600, compound
Reaction equation
[C:40]([c:41]1[cH:42][n:43][cH:44][cH:45][cH:46]1)(=[O:47])[Cl:48].[CH2:1]([CH:2]([CH3:3])[CH3:4])[NH:5][CH2:6][CH2:7][c:8]1[c:9](-[c:14]2[cH:15][cH:16][c:17]([O:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][O:24][c:25]3[cH:26][cH:27][c:28]([C:29]#[N:30])[cH:31][cH:32]3)[cH:33][cH:34]2)[n:10][c:11]([CH3:13])[s:12]1.[CH3:35][N:36]([CH3:37])[CH:38]=[O:39].[CH3:51][CH2:52][O:53][C:54](=[O:55])[CH3:56].[CH3:57][OH:58].[CH3:59][CH2:60][CH2:61][CH2:62][CH2:63][CH3:64].[H-:49].[Na+:50]>>[CH2:1]([CH:2]([CH3:3])[CH3:4])[N:5]([CH2:6][CH2:7][c:8]1[c:9](-[c:14]2[cH:15][cH:16][c:17]([O:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][O:24][c:25]3[cH:26][cH:27][c:28]([C:29]#[N:30])[cH:31][cH:32]3)[cH:33][cH:34]2)[n:10][c:11]([CH3:13])[s:12]1)[C:40]([c:41]1[cH:42][n:43][cH:44][cH:45][cH:46]1)=[O:47]Participants
9
Sources & evidence
- ORD record
- ord-ac5336b2f87a4102a0b0c5302ee8c60f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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