Hydrochloric Acid → 1-[(2-Benzothienylcarbonyl)amino]cyclohexanecarboxylic acid phenylmethyl ester
Reaction equation
[CH2:2]([N:3]=[C:4]=[N:5][CH2:6][CH2:7][CH2:8][N:9]([CH3:10])[CH3:11])[CH3:12].[CH2:52]([Cl:53])[Cl:54].[ClH:1].[OH:42][n:43]1[c:44]2[cH:45][cH:46][cH:47][cH:48][c:49]2[n:50][n:51]1.[c:25]1([CH2:31][O:32][C:33](=[O:34])[C:35]2([NH2:41])[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]2)[cH:26][cH:27][cH:28][cH:29][cH:30]1.[s:13]1[c:14]([C:22](=[O:23])[OH:24])[cH:15][c:16]2[c:17]1[cH:18][cH:19][cH:20][cH:21]2>>[s:13]1[c:14]([C:22](=[O:24])[NH:41][C:35]2([C:33]([O:32][CH2:31][c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)=[O:34])[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]2)[cH:15][c:16]2[c:17]1[cH:18][cH:19][cH:20][cH:21]2Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-1d11042cd4cc4b1c9f9373bb040848ef
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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