Diethyl Ether → HCID 68690301, compound
Reaction equation
[CH3:42][CH2:43][O:44][CH2:45][CH3:46].[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8](=[O:9])[N:10]2[CH2:11][c:12]3[n:13]([c:21]([C:24](=[O:25])[NH:26][CH2:27][c:28]4[cH:29][n:30][cH:31][cH:32][cH:33]4)[cH:22][cH:23]3)[CH2:14][c:15]3[c:16]2[cH:17][cH:18][cH:19][cH:20]3)[cH:6][n:7]1.[Cl:47][CH2:48][Cl:49].[NH2:34][CH2:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1>>[c:2]1([NH:34][CH2:35][c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[cH:3][cH:4][c:5]([C:8](=[O:9])[N:10]2[CH2:11][c:12]3[n:13]([c:21]([C:24](=[O:25])[NH:26][CH2:27][c:28]4[cH:29][n:30][cH:31][cH:32][cH:33]4)[cH:22][cH:23]3)[CH2:14][c:15]3[c:16]2[cH:17][cH:18][cH:19][cH:20]3)[cH:6][n:7]1Participants
5
Sources & evidence
- ORD record
- ord-bd9bfaeef6444e5fb7efac0d4aea04f3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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