Water → HCID 49764142, compound
Reaction equation
[Cl:96][CH2:97][Cl:98].[F:1][c:2]1[c:3](-[c:9]2[n:10][c:11]3[c:12]([c:13]4[cH:14][cH:15][c:16]([C:19](=[O:20])[O:21][CH3:22])[cH:17][c:18]24)[n:23]([CH2:37][O:38][CH2:39][CH2:40][Si:41]([CH3:42])([CH3:43])[CH3:44])[n:24][c:25]3[NH:26][CH:27]2[CH2:28][CH2:29][N:30]([S:33](=[O:34])(=[O:35])[CH3:36])[CH2:31][CH2:32]2)[c:4]([F:8])[cH:5][cH:6][cH:7]1.[F:45][c:46]1[cH:47][cH:48][cH:49][c:50]([F:51])[c:52]1-[c:53]1[c:54]2[cH:55][c:56]([C:57]([O:58][CH3:59])=[O:60])[cH:61][cH:62][c:63]2[c:64]2[n:65][n:66]([CH2:67][O:68][CH2:69][CH2:70][Si:71]([CH3:72])([CH3:73])[CH3:74])[c:75]([NH:76][CH:77]3[CH2:78][CH2:79][N:80]([S:81]([CH3:82])(=[O:83])=[O:84])[CH2:85][CH2:86]3)[c:87]2[n:88]1.[F:89][C:90]([F:91])([F:92])[C:93]([OH:94])=[O:95].[OH2:99]>>[F:1][c:2]1[c:3](-[c:9]2[n:10][c:11]3[c:12]([c:13]4[cH:14][cH:15][c:16]([C:19](=[O:20])[O:21][CH3:22])[cH:17][c:18]24)[nH:23][n:24][c:25]3[NH:26][CH:27]2[CH2:28][CH2:29][N:30]([S:33](=[O:34])(=[O:35])[CH3:36])[CH2:31][CH2:32]2)[c:4]([F:8])[cH:5][cH:6][cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-e4409f24a27540059a007887aea9f3bf
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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