HCID 22033394, compound → HCID 22033185, compound
Reaction equation
[CH3:1][S:2]([O:3][CH2:6][CH2:7][CH2:8][c:9]1[cH:10][cH:11][c:12]([O:13][CH2:14][CH2:15][CH2:16][CH:17]2[C:18]([CH3:31])([c:32]3[cH:33][cH:34][c:35]([O:38][CH2:39][O:40][CH3:41])[cH:36][cH:37]3)[CH2:19][O:20][c:21]3[cH:22][c:23]([O:27][CH2:28][O:29][CH3:30])[cH:24][cH:25][c:26]32)[cH:42][cH:43]1)(=[O:4])=[O:5].[CH3:44][O:45][c:46]1[cH:47][c:48]2[c:49]([cH:72][cH:73]1)[CH:50]([CH2:51][CH2:52][CH2:53][CH2:54][CH2:55][CH2:56][CH2:57][CH2:58][CH2:59][S:74][CH2:75][CH2:76][CH2:77][C:78]([C:79]([F:80])([F:81])[F:82])([F:83])[F:84])[C:60]([c:61]1[cH:62][cH:63][c:64]([O:65][CH3:66])[cH:67][cH:68]1)([CH3:69])[CH2:70][S:71]2>>[CH2:6]([CH2:7][CH2:8][c:9]1[cH:10][cH:11][c:12]([O:13][CH2:14][CH2:15][CH2:16][CH:17]2[C:18]([CH3:31])([c:32]3[cH:33][cH:34][c:35]([O:38][CH2:39][O:40][CH3:41])[cH:36][cH:37]3)[CH2:19][O:20][c:21]3[cH:22][c:23]([O:27][CH2:28][O:29][CH3:30])[cH:24][cH:25][c:26]32)[cH:42][cH:43]1)[S:74][CH2:75][CH2:76][CH2:77][C:78]([C:79]([F:80])([F:81])[F:82])([F:83])[F:84]Participants
3
Sources & evidence
- ORD record
- ord-4aa863811af04aae9c8056dc30e4d8d6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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