Tecastemizole → HCID 9851964, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[C:9](=[O:27])[C:10]([CH2:13][CH2:14][O:15][S:16]([CH3:17])(=[O:18])=[O:19])([CH2:20][c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[CH2:11][CH2:12]1.[F:28][c:29]1[cH:30][cH:31][c:32]([CH2:33][n:34]2[c:35]([NH:43][CH:44]3[CH2:45][CH2:46][NH:47][CH2:48][CH2:49]3)[n:36][c:37]3[c:38]2[cH:39][cH:40][cH:41][cH:42]3)[cH:50][cH:51]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[C:9](=[O:27])[C:10]([CH2:13][CH2:14][N:47]2[CH2:46][CH2:45][CH:44]([NH:43][c:35]3[n:34]([CH2:33][c:32]4[cH:31][cH:30][c:29]([F:28])[cH:51][cH:50]4)[c:38]4[c:37]([n:36]3)[cH:42][cH:41][cH:40][cH:39]4)[CH2:49][CH2:48]2)([CH2:20][c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[CH2:11][CH2:12]1Participants
3
Sources & evidence
- ORD record
- ord-9cc9df790c844f92b9b4a49ce5d017d2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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