Hydrochloric Acid → HCID 66841960, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([N:7]([CH3:8])[c:9]1[cH:10][cH:11][c:12]2[c:13]([S:27][c:28]3[c:29]([Br:34])[cH:30][cH:31][cH:32][cH:33]3)[cH:14][n:15]([CH2:18][c:19]3[cH:20][c:21]([F:26])[cH:22][c:23]([F:25])[cH:24]3)[c:16]2[cH:17]1)=[O:35].[CH2:36]([CH3:37])[O:38][C:39]([Sn:40]([CH2:41][CH2:42][CH2:43][CH3:44])([CH2:45][CH2:46][CH2:47][CH3:48])[CH2:49][CH2:50][CH2:51][CH3:52])=[CH2:53].[CH3:55][c:56]1[cH:57][cH:58][cH:59][cH:60][cH:61]1.[ClH:54].[Pd:62]([Cl:63])[Cl:64].[c:65]1([P:66]([c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)[c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)[cH:79][cH:80][cH:81][cH:82][cH:83]1.[c:84]1([P:85]([c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)[c:92]2[cH:93][cH:94][cH:95][cH:96][cH:97]2)[cH:98][cH:99][cH:100][cH:101][cH:102]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([N:7]([CH3:8])[c:9]1[cH:10][cH:11][c:12]2[c:13]([S:27][c:28]3[c:29]([C:36]([CH3:37])=[O:38])[cH:30][cH:31][cH:32][cH:33]3)[cH:14][n:15]([CH2:18][c:19]3[cH:20][c:21]([F:26])[cH:22][c:23]([F:25])[cH:24]3)[c:16]2[cH:17]1)=[O:35]Participants
7
Sources & evidence
- ORD record
- ord-52c3d665803e42d6ac77f03439ea619b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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