Hydrochloric Acid → (+/-)-1-(3-Amino-4-cyano-benzyl)-4-(6-chloro-benzo[b]thiophene-2-sulfonyl)-6-oxo-piperazine-2-carboxylic acid methyl ester
Reaction equation
[CH2:49]1[O:50][CH2:51][CH2:52][CH2:53]1.[CH3:2][O:3][C:4](=[O:5])[CH:6]1[N:7]([CH2:26][c:27]2[cH:28][c:29]([N:35]=[C:36]([c:37]3[cH:38][cH:39][cH:40][cH:41][cH:42]3)[c:43]3[cH:44][cH:45][cH:46][cH:47][cH:48]3)[c:30]([C:33]#[N:34])[cH:31][cH:32]2)[C:8](=[O:25])[CH2:9][N:10]([S:12](=[O:13])(=[O:14])[c:15]2[cH:16][c:17]3[c:18]([s:19]2)[cH:20][c:21]([Cl:24])[cH:22][cH:23]3)[CH2:11]1.[CH3:54][OH:55].[ClH:1]>>[CH3:2][O:3][C:4](=[O:5])[CH:6]1[N:7]([CH2:26][c:27]2[cH:28][c:29]([NH2:35])[c:30]([C:33]#[N:34])[cH:31][cH:32]2)[C:8](=[O:25])[CH2:9][N:10]([S:12](=[O:13])(=[O:14])[c:15]2[cH:16][c:17]3[c:18]([s:19]2)[cH:20][c:21]([Cl:24])[cH:22][cH:23]3)[CH2:11]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-ca3a1a0396a14da4a038524eabeef6cc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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