Isopropanol → HCID 86633968, compound
Reaction equation
[C:1](#[N:2])[CH2:3][NH:4][C:5]([c:6]1[c:7]([NH:13][c:14]2[n:15][c:16]([Cl:21])[n:17][cH:18][c:19]2[Cl:20])[c:8]([CH3:12])[cH:9][cH:10][cH:11]1)=[O:22].[C:38]12([CH2:39][S:40]([OH:41])(=[O:42])=[O:43])[C:44]([CH3:45])([CH3:46])[CH:47]([CH2:48][CH2:49]1)[CH2:50][C:51]2=[O:52].[CH:53]([OH:54])([CH3:55])[CH3:56].[NH2:23][c:24]1[cH:25][c:26]2[c:27]([cH:36][cH:37]1)[NH:28][C:29](=[O:35])[CH2:30][CH2:31][C:32]2([CH3:33])[CH3:34]>>[C:1](#[N:2])[CH2:3][NH:4][C:5]([c:6]1[c:7]([NH:13][c:14]2[n:15][c:16]([NH:23][c:24]3[cH:25][c:26]4[c:27]([cH:36][cH:37]3)[NH:28][C:29](=[O:35])[CH2:30][CH2:31][C:32]4([CH3:33])[CH3:34])[n:17][cH:18][c:19]2[Cl:20])[c:8]([CH3:12])[cH:9][cH:10][cH:11]1)=[O:22]Participants
5
Sources & evidence
- ORD record
- ord-de159337ce08479c88f17c34414ecd4a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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