Ethanol → HCID 68458795, compound
Reaction equation
[CH3:15][CH2:16][OH:17].[Cl:1][c:2]1[c:3]2[cH:4][cH:5][c:6]([CH2:12][CH2:13][CH3:14])[n:7][c:8]2[n:9][cH:10][cH:11]1.[NH2:18][c:19]1[c:20]([S:26][c:27]2[cH:28][cH:29][c:30]([CH2:33][OH:34])[cH:31][cH:32]2)[cH:21][cH:22][c:23]([CH3:25])[cH:24]1>>[c:2]1([NH:18][c:19]2[c:20]([S:26][c:27]3[cH:28][cH:29][c:30]([CH2:33][OH:34])[cH:31][cH:32]3)[cH:21][cH:22][c:23]([CH3:25])[cH:24]2)[c:3]2[cH:4][cH:5][c:6]([CH2:12][CH2:13][CH3:14])[n:7][c:8]2[n:9][cH:10][cH:11]1Participants
4
Sources & evidence
- ORD record
- ord-dd1adba1437f489cb1b7c7a7bc6e2cc7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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