Pyridine → HCID 145857654, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][C:8](=[NH:9])[c:10]1[s:11][c:12]([S:32][CH3:33])[c:13]([S:15](=[O:16])(=[O:17])[c:18]2[cH:19][c:20](-[c:24]3[c:25]([NH2:31])[cH:26][cH:27][cH:28][c:29]3[CH3:30])[cH:21][cH:22][cH:23]2)[cH:14]1)=[O:34].[C:54]([c:55]1[cH:56][cH:57][cH:58][cH:59][cH:60]1)([c:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1)([c:67]1[cH:68][cH:69][cH:70][cH:71][cH:72]1)[n:73]1[n:74][c:75]([CH2:78][CH2:79][CH2:80][CH2:81][NH2:82])[n:76][n:77]1.[Cl:41][C:42](=[O:43])[O:44][c:45]1[cH:46][cH:47][c:48]([N+:49]([O-:50])=[O:51])[cH:52][cH:53]1.[Cl:83][CH2:84][Cl:85].[cH:35]1[cH:36][cH:37][n:38][cH:39][cH:40]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][C:8](=[NH:9])[c:10]1[s:11][c:12]([S:32][CH3:33])[c:13]([S:15](=[O:16])(=[O:17])[c:18]2[cH:19][c:20](-[c:24]3[c:25]([NH:31][C:42](=[O:43])[NH:82][CH2:81][CH2:80][CH2:79][CH2:78][c:75]4[n:74][n:73]([C:54]([c:55]5[cH:56][cH:57][cH:58][cH:59][cH:60]5)([c:61]5[cH:62][cH:63][cH:64][cH:65][cH:66]5)[c:67]5[cH:68][cH:69][cH:70][cH:71][cH:72]5)[n:77][n:76]4)[cH:26][cH:27][cH:28][c:29]3[CH3:30])[cH:21][cH:22][cH:23]2)[cH:14]1)=[O:34]Participants
6
Sources & evidence
- ORD record
- ord-a7b1667f0876431fabc8330b625edad4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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