Thiophenol → 4-chloro-N-[1-(3-chlorophenyl)ethyl]-3-phenylsulfanylbenzamide
Reaction equation
[Br:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[NH:7][CH:8]([CH3:9])[c:10]2[cH:11][c:12]([Cl:16])[cH:13][cH:14][cH:15]2)[cH:17][cH:18][c:19]1[Cl:20].[CH2:70]([N:71]([CH:72]([CH3:73])[CH3:74])[CH:75]([CH3:76])[CH3:77])[CH3:78].[O:117]=[C:118]([CH:119]=[CH:120][c:121]1[cH:122][cH:123][cH:124][cH:125][cH:126]1)[CH:127]=[CH:128][c:129]1[cH:130][cH:131][cH:132][cH:133][cH:134]1.[O:135]1[CH2:136][CH2:137][O:138][CH2:139][CH2:140]1.[O:81]=[C:82]([CH:83]=[CH:84][c:85]1[cH:86][cH:87][cH:88][cH:89][cH:90]1)[CH:91]=[CH:92][c:93]1[cH:94][cH:95][cH:96][cH:97][cH:98]1.[O:99]=[C:100]([CH:101]=[CH:102][c:103]1[cH:104][cH:105][cH:106][cH:107][cH:108]1)[CH:109]=[CH:110][c:111]1[cH:112][cH:113][cH:114][cH:115][cH:116]1.[Pd:79].[Pd:80].[SH:63][c:64]1[cH:65][cH:66][cH:67][cH:68][cH:69]1.[c:21]1([P:22]([c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[c:29]2[c:30]3[c:54]([cH:55][cH:56][cH:57]2)[C:51]([CH3:52])([CH3:53])[c:33]2[c:32]([c:37]([P:38]([c:39]4[cH:40][cH:41][cH:42][cH:43][cH:44]4)[c:45]4[cH:46][cH:47][cH:48][cH:49][cH:50]4)[cH:36][cH:35][cH:34]2)[O:31]3)[cH:58][cH:59][cH:60][cH:61][cH:62]1>>[c:2]1([S:63][c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[cH:3][c:4]([C:5](=[O:6])[NH:7][CH:8]([CH3:9])[c:10]2[cH:11][c:12]([Cl:16])[cH:13][cH:14][cH:15]2)[cH:17][cH:18][c:19]1[Cl:20]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-152b8301b3464fe69c310db899239e0b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
Loading…