Formic Acid → 1-[3-({1-[Bis-(4-chlorophenyl)methyl]azetidin-3-ylidene}methanesulfonylmethyl)phenyl]piperazine
Reaction equation
[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[cH:15][c:16]([CH2:20][S:21](=[O:22])(=[O:23])[CH:24]=[C:25]3[CH2:26][N:27]([CH:29]([c:30]4[cH:31][cH:32][c:33]([Cl:36])[cH:34][cH:35]4)[c:37]4[cH:38][cH:39][c:40]([Cl:43])[cH:41][cH:42]4)[CH2:28]3)[cH:17][cH:18][cH:19]2)[CH2:12][CH2:13]1)([CH3:5])([CH3:6])[CH3:7].[CH:44]([OH:45])=[O:46]>>[NH:8]1[CH2:9][CH2:10][N:11]([c:14]2[cH:15][c:16]([CH2:20][S:21](=[O:22])(=[O:23])[CH:24]=[C:25]3[CH2:26][N:27]([CH:29]([c:30]4[cH:31][cH:32][c:33]([Cl:36])[cH:34][cH:35]4)[c:37]4[cH:38][cH:39][c:40]([Cl:43])[cH:41][cH:42]4)[CH2:28]3)[cH:17][cH:18][cH:19]2)[CH2:12][CH2:13]1Participants
3
Sources & evidence
- ORD record
- ord-889ad61010544d9689c019d63c143f0b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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