Isopropanol → HCID 178491950, compound
Reaction equation
[CH3:21][CH2:22][N:23]([CH2:24][CH3:25])[CH2:26][CH3:27].[CH3:43][CH:44]([OH:45])[CH3:46].[Cl:28][c:29]1[n:30][cH:31][n:32][c:33]2[cH:34][cH:35][c:36]([C:39]([F:40])([F:41])[F:42])[cH:37][c:38]12.[NH2:1][CH:2]1[C:3](=[O:20])[N:4]([CH:7]2[CH:8]([CH2:15][NH:16][C:17]([CH3:18])=[O:19])[CH2:9][CH:10]([O:13][CH3:14])[CH2:11][CH2:12]2)[CH2:5][CH2:6]1>>[NH:1]([CH:2]1[C:3](=[O:20])[N:4]([CH:7]2[CH:8]([CH2:15][NH:16][C:17]([CH3:18])=[O:19])[CH2:9][CH:10]([O:13][CH3:14])[CH2:11][CH2:12]2)[CH2:5][CH2:6]1)[c:29]1[n:30][cH:31][n:32][c:33]2[cH:34][cH:35][c:36]([C:39]([F:40])([F:41])[F:42])[cH:37][c:38]12Participants
5
Sources & evidence
- ORD record
- ord-a27034e7fafb4aeaa4ce0d7f620d0aa5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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