HCID 25160968, compound → HCID 25160969, compound
Reaction equation
[CH:1]1([CH2:4][n:5]2[c:6]([CH2:18][O:19][CH2:20][C:21]3([c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[CH2:22][CH2:23][N:24]([C:27]([O:28][C:29]([CH3:30])([CH3:31])[CH3:32])=[O:33])[CH2:25][CH2:26]3)[n:7][c:8]3[c:9]2[cH:10][cH:11][c:12]([C:14]([F:15])([F:16])[F:17])[cH:13]3)[CH2:2][CH2:3]1.[CH:40]1([CH2:41][n:42]2[c:43]3[cH:44][cH:45][c:46](-[c:47]4[cH:48][cH:49][c:50]([C:51]#[N:52])[cH:53][cH:54]4)[cH:55][c:56]3[n:57][c:58]2[CH2:59][O:60][CH2:61][C:62]2([c:63]3[cH:64][cH:65][cH:66][cH:67][cH:68]3)[CH2:69][CH2:70][N:71]([CH3:72])[CH2:73][CH2:74]2)[CH2:75][CH2:76]1>>[CH:1]1([CH2:4][n:5]2[c:6]([CH2:18][O:19][CH2:20][C:21]3([c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[CH2:22][CH2:23][N:24]([CH3:27])[CH2:25][CH2:26]3)[n:7][c:8]3[c:9]2[cH:10][cH:11][c:12]([C:14]([F:15])([F:16])[F:17])[cH:13]3)[CH2:2][CH2:3]1Participants
3
Sources & evidence
- ORD record
- ord-1cf45adbbb9942f78003ecf758011f40
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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