Dichloromethane → HCID 178485647, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][C:9]([CH2:10][CH:11]=[CH:12][C:13](=[O:14])[OH:15])([CH3:16])[CH3:17].[CH2:77]([Cl:78])[Cl:79].[CH3:28][N:29]([CH3:30])[CH2:31][CH2:32][CH2:33][N:34]=[C:35]=[N:36][CH2:37][CH3:38].[CH:68]([N:69]([CH:70]([CH3:71])[CH3:72])[CH2:73][CH3:74])([CH3:75])[CH3:76].[OH:18][n:19]1[c:20]2[n:21][cH:22][cH:23][cH:24][c:25]2[n:26][n:27]1.[s:39]1[c:40]2[c:41]([c:42]([CH2:44][CH:45]([C:46](=[O:47])[N:48]([CH:49]([CH2:50][c:51]3[cH:52][cH:53][cH:54][cH:55][cH:56]3)[C:57]([NH:58][CH3:59])=[O:60])[CH3:61])[NH:62][CH3:63])[cH:43]1)[cH:64][cH:65][cH:66][cH:67]2>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][C:9]([CH2:10][CH:11]=[CH:12][C:13](=[O:15])[N:62]([CH:45]([CH2:44][c:42]1[c:41]2[c:40]([s:39][cH:43]1)[cH:67][cH:66][cH:65][cH:64]2)[C:46](=[O:47])[N:48]([CH:49]([CH2:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1)[C:57]([NH:58][CH3:59])=[O:60])[CH3:61])[CH3:63])([CH3:16])[CH3:17]Participants
7
Sources & evidence
- ORD record
- ord-bfa002cd583548df9f49c88f29fdfeab
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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