Ethanol → HCID 3076390, compound
Reaction equation
[CH3:36][CH2:37][OH:38].[Cl:1][c:2]1[cH:3][cH:4][cH:5][c:6]([C:7]([O:8][OH:10])=[O:9])[cH:11]1.[NH:12]=[c:13]1[s:14][c:15]2[c:16]([n:17]1[CH2:18][CH2:19][S:20][c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)[cH:27][cH:28][c:29]([O:31][C:32]([F:33])([F:34])[F:35])[cH:30]2>>[O:9]=[S:20]([CH2:19][CH2:18][n:17]1[c:13](=[NH:12])[s:14][c:15]2[c:16]1[cH:27][cH:28][c:29]([O:31][C:32]([F:33])([F:34])[F:35])[cH:30]2)[c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1Participants
4
Sources & evidence
- ORD record
- ord-2db7670c6e2d4d1fb64c130e16e6a3df
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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