Hydrochloric Acid → HCID 73041485, compound
Reaction equation
[CH3:2][O:3][NH2:4].[CH3:45][C:46]#[N:47].[CH3:48][CH2:49][OH:50].[CH3:5][CH2:6][N:7]([CH2:8][CH3:9])[CH2:10][CH3:11].[Cl:12][c:13]1[cH:14][cH:15][c:16](-[c:19]2[cH:20][cH:21][c:22]([C:25]#[C:26][c:27]3[cH:28][cH:29][c:30]([O:35][CH2:36][CH2:37][N:38]4[CH2:39][CH2:40][CH:41]([CH3:44])[CH2:42][CH2:43]4)[c:31]([CH:32]=[O:33])[cH:34]3)[n:23][cH:24]2)[cH:17][cH:18]1.[ClH:1].[OH2:51]>>[CH3:2][O:3][N:4]=[CH:32][c:31]1[c:30]([O:35][CH2:36][CH2:37][N:38]2[CH2:39][CH2:40][CH:41]([CH3:44])[CH2:42][CH2:43]2)[cH:29][cH:28][c:27]([C:26]#[C:25][c:22]2[cH:21][cH:20][c:19](-[c:16]3[cH:15][cH:14][c:13]([Cl:12])[cH:18][cH:17]3)[cH:24][n:23]2)[cH:34]1Participants
8
Sources & evidence
- ORD record
- ord-786008f2f16b43499c2a9d3d3c8647b4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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