Ethanol → HCID 22909220, compound
Reaction equation
[CH2:26]([CH3:27])[I:28].[CH3:40][CH2:41][OH:42].[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8][c:9]2[c:10]([CH3:25])[c:11]([C:23]#[N:24])[c:12](=[O:22])[n:13](-[c:15]3[cH:16][cH:17][c:18]([OH:21])[cH:19][cH:20]3)[n:14]2)[cH:6][cH:7]1.[N:29]12[CH2:30][CH2:31][CH2:32][NH:33][CH:34]1[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39]2>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8][c:9]2[c:10]([CH3:25])[c:11]([C:23]#[N:24])[c:12](=[O:22])[n:13](-[c:15]3[cH:16][cH:17][c:18]([O:21][CH2:26][CH3:27])[cH:19][cH:20]3)[n:14]2)[cH:6][cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-a5421c93c6b046398a225d2c970dc920
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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