Ammonium → 4-(3-Fluoro-benzyl)-5-oxo-7-[4-(thiophene-2-carbonyl)-piperazin-1-yl]-4,5-dihydro-thieno[3,2-b]pyridine-6-carboxylic acid ethyl ester
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[c:7]([Cl:24])[c:8]2[c:9]([n:10]([CH2:13][c:14]3[cH:15][c:16]([F:20])[cH:17][cH:18][cH:19]3)[c:11]1=[O:12])[cH:21][cH:22][s:23]2.[Cl-:46].[N:25]12[CH2:26][CH2:27][N:28]([CH2:29][CH2:30]1)[CH2:31][CH2:32]2.[N:33]1([C:39](=[O:40])[c:41]2[s:42][cH:43][cH:44][cH:45]2)[CH2:34][CH2:35][NH:36][CH2:37][CH2:38]1.[NH4+:47].[O:48]=[CH:49][N:50]([CH3:51])[CH3:52]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[c:7]([N:36]2[CH2:35][CH2:34][N:33]([C:39](=[O:40])[c:41]3[s:42][cH:43][cH:44][cH:45]3)[CH2:38][CH2:37]2)[c:8]2[c:9]([n:10]([CH2:13][c:14]3[cH:15][c:16]([F:20])[cH:17][cH:18][cH:19]3)[c:11]1=[O:12])[cH:21][cH:22][s:23]2Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-f4d520c31c314317beebc6f62c69e085
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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