Hydrochloric Acid → HCID 53796003, compound
Reaction equation
[CH2:1]([CH2:2][CH3:3])[S:4][CH:5]1[CH2:6][CH2:7][N:8]([c:11]2[cH:12][cH:13][c:14]([N:17]3[CH2:18][CH2:19][N:20]([c:23]4[cH:24][cH:25][c:26]([C:27](=[O:28])[OH:29])[cH:30][cH:31]4)[CH2:21][CH2:22]3)[cH:15][cH:16]2)[CH2:9][CH2:10]1.[CH2:43]([N:44]=[C:45]=[N:46][CH2:47][CH2:48][CH2:49][N:50]([CH3:51])[CH3:52])[CH3:53].[CH3:54][CH2:55][N:56]([CH2:57][CH3:58])[CH2:59][CH3:60].[Cl:61][CH2:62][Cl:63].[ClH:42].[OH:32][n:33]1[n:34][n:35][c:36]2[c:37]1[cH:38][cH:39][cH:40][cH:41]2>>[CH2:1]([CH2:2][CH3:3])[S:4][CH:5]1[CH2:6][CH2:7][N:8]([c:11]2[cH:12][cH:13][c:14]([N:17]3[CH2:18][CH2:19][N:20]([c:23]4[cH:24][cH:25][c:26]([C:27]([O:28][n:33]5[n:34][n:35][c:36]6[c:37]5[cH:38][cH:39][cH:40][cH:41]6)=[O:29])[cH:30][cH:31]4)[CH2:21][CH2:22]3)[cH:15][cH:16]2)[CH2:9][CH2:10]1Participants
7
Sources & evidence
- ORD record
- ord-f61307c894f6407d96cc20e333590fd1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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