Hydrochloric Acid → HCID 9924833, compound
Reaction equation
[CH3:36][CH2:37][O:38][CH2:39][CH2:40][OH:41].[Cl:1][c:2]1[c:3]([C:16]#[N:17])[cH:4][n:5][c:6]2[cH:7][c:8]([O:14][CH3:15])[c:9]([O:12][CH3:13])[cH:10][c:11]12.[ClH:29].[NH2:18][c:19]1[cH:20][c:21]2[cH:22][cH:23][cH:24][n:25][c:26]2[cH:27][cH:28]1.[n:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1>>[c:2]1([NH:18][c:19]2[cH:20][c:21]3[cH:22][cH:23][cH:24][n:25][c:26]3[cH:27][cH:28]2)[c:3]([C:16]#[N:17])[cH:4][n:5][c:6]2[cH:7][c:8]([O:14][CH3:15])[c:9]([O:12][CH3:13])[cH:10][c:11]12Participants
6
Sources & evidence
- ORD record
- ord-93be1c9d5106464abe0211c4ff7c41b4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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