Hydrochloric Acid → HCID 69156431, compound
Reaction equation
[CH2:44]([N:45]=[C:46]=[N:47][CH2:48][CH2:49][CH2:50][N:51]([CH3:52])[CH3:53])[CH3:54].[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6]([CH2:26][c:27]2[cH:28][cH:29][c:30]([S:33](=[O:34])(=[O:35])[CH3:36])[cH:31][cH:32]2)[c:7](=[O:25])[c:8]2[cH:9][cH:10][c:11]([Cl:24])[cH:12][c:13]2[c:14]1-[c:15]1[cH:16][c:17]([C:21](=[O:22])[OH:23])[cH:18][cH:19][cH:20]1.[CH3:37][N:38]([CH2:39][CH2:40][NH2:41])[CH3:42].[CH3:66][C:67]#[N:68].[ClH:43].[OH2:55].[OH:56][c:57]1[c:58]2[n:59][n:60][nH:61][c:62]2[cH:63][cH:64][cH:65]1>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6]([CH2:26][c:27]2[cH:28][cH:29][c:30]([S:33](=[O:34])(=[O:35])[CH3:36])[cH:31][cH:32]2)[c:7](=[O:25])[c:8]2[cH:9][cH:10][c:11]([Cl:24])[cH:12][c:13]2[c:14]1-[c:15]1[cH:16][c:17]([C:21](=[O:22])[NH:41][CH2:40][CH2:39][N:38]([CH3:37])[CH3:42])[cH:18][cH:19][cH:20]1Participants
8
Sources & evidence
- ORD record
- ord-ca390e3cb8b442a4b45f91750f3ee993
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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