Hydrochloric Acid → HCID 10697861, compound
Reaction equation
[Br:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][C:7]([C:8]#[N:9])([S:10][c:11]1[n:12][cH:13][cH:14][cH:15][cH:16]1)[c:17]1[cH:18][c:19]([O:25][CH3:26])[c:20]([O:23][CH3:24])[cH:21][cH:22]1.[CH3:28][O:29][c:30]1[cH:31][c:32]2[c:37]([cH:38][c:39]1[O:40][CH3:41])[CH2:36][NH:35][CH2:34][CH2:33]2.[CH3:51][C:52]#[N:53].[CH:42]([N:43]([CH2:44][CH3:45])[CH:46]([CH3:47])[CH3:48])([CH3:49])[CH3:50].[ClH:27]>>[CH2:2]([CH2:3][CH2:4][CH2:5][CH2:6][C:7]([C:8]#[N:9])([S:10][c:11]1[n:12][cH:13][cH:14][cH:15][cH:16]1)[c:17]1[cH:18][c:19]([O:25][CH3:26])[c:20]([O:23][CH3:24])[cH:21][cH:22]1)[N:35]1[CH2:34][CH2:33][c:32]2[cH:31][c:30]([O:29][CH3:28])[c:39]([O:40][CH3:41])[cH:38][c:37]2[CH2:36]1Participants
6
Sources & evidence
- ORD record
- ord-ee9fcef3ce39492bb8075f2f88255dea
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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