Benzyl mercaptan → HCID 67155527, compound
Reaction equation
[Br:1][c:2]1[c:3]([F:15])[c:4]([N:9]2[C:10](=[O:14])[CH2:11][CH2:12][CH2:13]2)[cH:5][cH:6][c:7]1[F:8].[CH:16]([N:17]([CH2:18][CH3:19])[CH:20]([CH3:21])[CH3:22])([CH3:23])[CH3:24].[O:33]1[CH2:34][CH2:35][O:36][CH2:37][CH2:38]1.[O:41]=[C:42]([CH:43]=[CH:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1)[CH:51]=[CH:52][c:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1.[O:59]=[C:60]([CH:61]=[CH:62][c:63]1[cH:64][cH:65][cH:66][cH:67][cH:68]1)[CH:69]=[CH:70][c:71]1[cH:72][cH:73][cH:74][cH:75][cH:76]1.[O:77]=[C:78]([CH:79]=[CH:80][c:81]1[cH:82][cH:83][cH:84][cH:85][cH:86]1)[CH:87]=[CH:88][c:89]1[cH:90][cH:91][cH:92][cH:93][cH:94]1.[Pd:39].[Pd:40].[c:25]1([CH2:31][SH:32])[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[c:2]1([S:32][CH2:31][c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[c:3]([F:15])[c:4]([N:9]2[C:10](=[O:14])[CH2:11][CH2:12][CH2:13]2)[cH:5][cH:6][c:7]1[F:8]Participants
7
Sources & evidence
- ORD record
- ord-b20698e57d1d461785d7a56484e3d171
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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