2,2,2-Trichloro-1-{10-[(4-chloro-2-methylphenoxy)acetyl]-10,11-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-3-yl}ethanone → 2,2,2-trichloro-1-{10-[(4-chlorophenoxy)acetyl]-10,11-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-3-yl}ethanone
Reaction equation
[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:6][CH2:7][C:8]([N:9]2[c:10]3[cH:11][cH:12][cH:13][cH:14][c:15]3[CH2:16][n:17]3[cH:18][cH:19][cH:20][c:21]3[CH2:22]2)=[O:23])[cH:24][cH:25]1.[Cl:26][C:27]([C:28](=[O:29])[c:30]1[cH:31][cH:32][c:33]2[n:39]1[CH2:38][c:37]1[c:36]([cH:43][cH:42][cH:41][cH:40]1)[N:35]([C:44]([CH2:45][O:46][c:47]1[c:48]([CH3:54])[cH:49][c:50]([Cl:53])[cH:51][cH:52]1)=[O:55])[CH2:34]2)([Cl:56])[Cl:57]>>[Cl:26][C:27]([C:28](=[O:29])[c:30]1[cH:31][cH:32][c:33]2[n:39]1[CH2:38][c:37]1[c:36]([cH:43][cH:42][cH:41][cH:40]1)[N:35]([C:44]([CH2:45][O:46][c:47]1[cH:48][cH:49][c:50]([Cl:53])[cH:51][cH:52]1)=[O:55])[CH2:34]2)([Cl:56])[Cl:57]Participants
3
Reactant 2
Product 1
Sources & evidence
- ORD record
- ord-ffb60de38a9e46c9975092bdab5ffca8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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