Methanol → HCID 69592056, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([O:14][c:15]2[c:16]([C:33]([NH2:34])=[O:35])[cH:17][c:18]([NH:21][CH2:22][CH:23]=[CH:24][c:25]3[cH:26][c:27]([C:28]#[N:29])[cH:30][cH:31][cH:32]3)[cH:19][cH:20]2)[CH2:12][CH2:13]1.[CH2:36]([CH3:37])[S:38](=[O:39])(=[O:40])[Cl:41].[CH3:48][OH:49].[Cl:50][CH2:51][Cl:52].[cH:42]1[cH:43][cH:44][n:45][cH:46][cH:47]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([O:14][c:15]2[c:16]([C:33]([NH2:34])=[O:35])[cH:17][c:18]([N:21]([CH2:22][CH:23]=[CH:24][c:25]3[cH:26][c:27]([C:28]#[N:29])[cH:30][cH:31][cH:32]3)[S:38]([CH2:36][CH3:37])(=[O:39])=[O:40])[cH:19][cH:20]2)[CH2:12][CH2:13]1Participants
6
Sources & evidence
- ORD record
- ord-120995fe1f2d405198429fe6bb309600
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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