Isopropanol → HCID 58659442, compound
Reaction equation
[CH:37]([OH:38])([CH3:39])[CH3:40].[Cl:1][c:2]1[n:3][cH:4][n:5][c:6]([O:8][c:9]2[cH:10][cH:11][c:12]([NH:15][C:16](=[O:17])[NH:18][c:19]3[cH:20][cH:21][c:22]([C:25]([CH3:26])([CH3:27])[CH3:28])[cH:23][cH:24]3)[cH:13][cH:14]2)[cH:7]1.[NH2:29][CH2:30][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[c:2]1([NH:29][CH2:30][c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[n:3][cH:4][n:5][c:6]([O:8][c:9]2[cH:10][cH:11][c:12]([NH:15][C:16](=[O:17])[NH:18][c:19]3[cH:20][cH:21][c:22]([C:25]([CH3:26])([CH3:27])[CH3:28])[cH:23][cH:24]3)[cH:13][cH:14]2)[cH:7]1Participants
4
Sources & evidence
- ORD record
- ord-cea962de6c304b228a5fae8aa5c1c086
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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