Benzene → 1-Carbethoxy-4-(8-chloro-2-methyl-dibenzo[b,f]thiepin-10-yl)-piperazine
Reaction equation
[C:19](=[O:20])([O:21][CH2:22][CH3:23])[N:24]1[CH2:25][CH2:26][NH:27][CH2:28][CH2:29]1.[C:30](=[O:31])([OH:32])[O-:33].[Cl-:35].[Cl-:36].[Cl-:37].[Cl-:38].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:18]1)[C:7](=[O:17])[CH2:8][c:9]1[c:10]([cH:12][cH:13][c:14]([CH3:16])[cH:15]1)[S:11]2.[Na+:34].[Ti+4:39].[cH:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:18]1)[C:7]([N:27]1[CH2:26][CH2:25][N:24]([C:19](=[O:20])[O:21][CH2:22][CH3:23])[CH2:29][CH2:28]1)=[CH:8][c:9]1[c:10]([cH:12][cH:13][c:14]([CH3:16])[cH:15]1)[S:11]2Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-b19e5ba8bdce49d9b548530fa3972015
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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