1-Butanol → HCID 21934643, compound
Reaction equation
[CH2:37]([OH:38])[CH2:39][CH2:40][CH3:41].[CH3:33][S:34]([CH3:35])=[O:36].[CH:9]([N:10]([CH:11]([CH3:12])[CH3:13])[CH2:14][CH3:15])([CH3:16])[CH3:17].[Cl:1][c:2]1[cH:3][c:4]([NH2:8])[n:5][cH:6][n:7]1.[N:18]1([CH2:24][CH2:25][CH2:26][N:27]2[CH2:28][CH2:29][O:30][CH2:31][CH2:32]2)[CH2:19][CH2:20][NH:21][CH2:22][CH2:23]1>>[c:2]1([N:21]2[CH2:20][CH2:19][N:18]([CH2:24][CH2:25][CH2:26][N:27]3[CH2:28][CH2:29][O:30][CH2:31][CH2:32]3)[CH2:23][CH2:22]2)[cH:3][c:4]([NH2:8])[n:5][cH:6][n:7]1Participants
6
Sources & evidence
- ORD record
- ord-5dbb4da8214a40b98d69d0409fafcb92
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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