Imidazole → HCID 178489521, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([CH2:48][OH:49])[CH:11]([c:28]2[cH:29][cH:30][c:31]([O:34][CH2:35][CH2:36][CH2:37][O:38][CH2:39][c:40]3[c:41]([O:46][CH3:47])[cH:42][cH:43][cH:44][cH:45]3)[cH:32][cH:33]2)[CH:12]([O:14][CH2:15][c:16]2[cH:17][c:18]3[cH:19][cH:20][cH:21][cH:22][c:23]3[c:24]([O:26][CH3:27])[cH:25]2)[CH2:13]1.[CH3:50][CH2:51][N:52]([CH2:53][CH3:54])[CH2:55][CH3:56].[CH3:57][S:58](=[O:59])(=[O:60])[Cl:61].[CH3:77][N:78]([CH3:79])[CH:80]=[O:81].[Cl:74][CH2:75][Cl:76].[H-:67].[Na+:68].[O:69]1[CH2:70][CH2:71][CH2:72][CH2:73]1.[nH:62]1[cH:63][n:64][cH:65][cH:66]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([CH2:48][n:62]2[cH:63][n:64][cH:65][cH:66]2)[CH:11]([c:28]2[cH:29][cH:30][c:31]([O:34][CH2:35][CH2:36][CH2:37][O:38][CH2:39][c:40]3[c:41]([O:46][CH3:47])[cH:42][cH:43][cH:44][cH:45]3)[cH:32][cH:33]2)[CH:12]([O:14][CH2:15][c:16]2[cH:17][c:18]3[cH:19][cH:20][cH:21][cH:22][c:23]3[c:24]([O:26][CH3:27])[cH:25]2)[CH2:13]1Participants
10
Sources & evidence
- ORD record
- ord-78c89d73f3684ddaa32d73cb5f8ac28a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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