1-Butanol → HCID 25159285, compound
Reaction equation
[C:33](=[O:34])([O-:35])[O-:36].[CH2:46]([OH:47])[CH2:48][CH2:49][CH3:50].[Cl:1][c:2]1[c:3]([NH:21][c:22]2[c:23]([C:24](=[O:25])[NH:26][CH3:27])[cH:28][cH:29][cH:30][c:31]2[F:32])[n:4][c:5]([NH:8][c:9]2[cH:10][cH:11][c:12]3[c:13]([cH:20]2)[NH:14][C:15](=[O:19])[CH2:16][NH:17][CH2:18]3)[n:6][cH:7]1.[I:39][CH2:40][CH2:41][C:42]([F:43])([F:44])[F:45].[K+:37].[K+:38]>>[Cl:1][c:2]1[c:3]([NH:21][c:22]2[c:23]([C:24](=[O:25])[NH:26][CH3:27])[cH:28][cH:29][cH:30][c:31]2[F:32])[n:4][c:5]([NH:8][c:9]2[cH:10][cH:11][c:12]3[c:13]([cH:20]2)[NH:14][C:15](=[O:19])[CH2:16][N:17]([CH2:40][CH2:41][C:42]([F:43])([F:44])[F:45])[CH2:18]3)[n:6][cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-1946804767a04c069e075964b3e40d12
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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