Ethanol → HCID 58215751, compound
Reaction equation
[CH3:34][CH2:35][OH:36].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([C:30]#[N:31])[c:7](-[c:12]3[cH:13][n:14][cH:15][c:16]([CH2:18][N:19]4[C:20](=[O:21])[c:22]5[c:23]([cH:24][cH:25][cH:26][cH:27]5)[C:28]4=[O:29])[cH:17]3)[n:8]([CH3:11])[c:9]2[cH:10]1.[NH2:32][NH2:33]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([C:30]#[N:31])[c:7](-[c:12]3[cH:13][n:14][cH:15][c:16]([CH2:18][NH2:19])[cH:17]3)[n:8]([CH3:11])[c:9]2[cH:10]1Participants
4
Sources & evidence
- ORD record
- ord-4305deceb7a14602866f3e0f9ff5ba09
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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