Dichloromethane → 5-(2-chlorophenyl)-1,2,3,6,7,9-hexahydro-3-hydroxy-N-(4-methoxy-2-nitrophenyl)-2-oxo-1-(2-phenylethyl)-8H-pyrido[4',3':4,5]thieno[2,3-e]-1,4-diazepine-8-carbothioamide
Reaction equation
[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[CH3:39][O:40][c:41]1[cH:42][c:43]([N+:50](=[O:51])[O-:52])[c:44]([N:47]=[C:48]=[S:49])[cH:45][cH:46]1.[Cl:1][c:2]1[c:3]([C:8]2=[N:14][CH:13]([OH:15])[C:12](=[O:16])[N:11]([CH2:17][CH2:18][c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[c:10]3[c:9]2[c:27]2[c:26]([s:25]3)[CH2:31][NH:30][CH2:29][CH2:28]2)[cH:4][cH:5][cH:6][cH:7]1.[Cl:53][CH2:54][Cl:55]>>[Cl:1][c:2]1[c:3]([C:8]2=[N:14][CH:13]([OH:15])[C:12](=[O:16])[N:11]([CH2:17][CH2:18][c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[c:10]3[c:9]2[c:27]2[c:26]([s:25]3)[CH2:31][N:30]([C:48]([NH:47][c:44]3[c:43]([N+:50](=[O:51])[O-:52])[cH:42][c:41]([O:40][CH3:39])[cH:46][cH:45]3)=[S:49])[CH2:29][CH2:28]2)[cH:4][cH:5][cH:6][cH:7]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-f25d41f86f83462598642b53a1513a5e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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