Hydrochloric Acid → HCID 178432106, compound
Reaction equation
[CH3:11][c:12]1[n:13][c:14]2[c:15]([n:16]1[CH:17]1[CH2:18][CH:19]3[CH2:20][CH2:21][CH:22]([CH2:23]1)[N:24]3[CH2:25][CH2:26][C:27]1([c:43]3[cH:44][cH:45][cH:46][cH:47][cH:48]3)[CH2:28][CH2:29][N:30]([C:33](=[O:34])[c:35]3[cH:36][c:37]([C:38]#[N:39])[cH:40][cH:41][cH:42]3)[CH2:31][CH2:32]1)[cH:49][cH:50][cH:51][cH:52]2.[CH3:4][CH2:5][N:6]([CH2:7][CH3:8])[CH2:9][CH3:10].[CH3:54][OH:55].[ClH:1].[NH2:2][OH:3].[OH2:53]>>[N:2]([OH:3])=[C:38]([c:37]1[cH:36][c:35]([C:33]([N:30]2[CH2:29][CH2:28][C:27]([CH2:26][CH2:25][N:24]3[CH:19]4[CH2:18][CH:17]([n:16]5[c:12]([CH3:11])[n:13][c:14]6[c:15]5[cH:49][cH:50][cH:51][cH:52]6)[CH2:23][CH:22]3[CH2:21][CH2:20]4)([c:43]3[cH:44][cH:45][cH:46][cH:47][cH:48]3)[CH2:32][CH2:31]2)=[O:34])[cH:42][cH:41][cH:40]1)[NH2:39]Participants
7
Sources & evidence
- ORD record
- ord-ab18e4e4cdb6443893f3477c594d5aeb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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