Isopropanol → HCID 72371137, compound
Reaction equation
[CH3:21][N:22]([CH:23]1[CH2:24][N:25]([c:28]2[cH:29][cH:30][c:31]([C:32](=[O:33])[OH:34])[cH:35][cH:36]2)[CH2:26][CH2:27]1)[CH3:37].[CH3:42][CH2:43][N:44]([CH2:45][CH3:46])[CH2:47][CH3:48].[CH:38]([OH:39])([CH3:40])[CH3:41].[Cl:49][CH2:50][Cl:51].[NH2:1][c:2]1[c:3]([NH:13][C:14]([O:15][C:16]([CH3:17])([CH3:18])[CH3:19])=[O:20])[cH:4][cH:5][c:6](-[c:8]2[s:9][cH:10][cH:11][cH:12]2)[cH:7]1>>[NH:1]([c:2]1[c:3]([NH:13][C:14]([O:15][C:16]([CH3:17])([CH3:18])[CH3:19])=[O:20])[cH:4][cH:5][c:6](-[c:8]2[s:9][cH:10][cH:11][cH:12]2)[cH:7]1)[C:32]([c:31]1[cH:30][cH:29][c:28]([N:25]2[CH2:24][CH:23]([N:22]([CH3:21])[CH3:37])[CH2:27][CH2:26]2)[cH:36][cH:35]1)=[O:33]Participants
6
Sources & evidence
- ORD record
- ord-4e59194505e24452b167434ee2420922
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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