N-{2-[5-(4-chloro-2-nitrophenyl)-1,3,4-thiadiazole-2-sulfonylamino]-ethyl}-glycine ethyl ester → HCID 136338634, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][NH:6][CH2:7][CH2:8][NH:9][S:10](=[O:11])(=[O:12])[c:13]1[s:14][c:15](-[c:18]2[c:19]([N+:25](=[O:26])[O-:27])[cH:20][c:21]([Cl:24])[cH:22][cH:23]2)[n:16][n:17]1)=[O:28].[CH3:29][O:30][c:31]1[cH:32][cH:33][c:34]([CH2:35][O:36][C:37](=[O:38])[NH:39][c:40]2[nH:41][c:42](=[O:53])[c:43]3[n:44][cH:45][n:46]([CH2:49][C:50](=[O:51])[OH:52])[c:47]3[n:48]2)[cH:54][cH:55]1>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][N:6]([CH2:7][CH2:8][NH:9][S:10](=[O:11])(=[O:12])[c:13]1[s:14][c:15](-[c:18]2[c:19]([N+:25](=[O:26])[O-:27])[cH:20][c:21]([Cl:24])[cH:22][cH:23]2)[n:16][n:17]1)[C:50]([CH2:49][n:46]1[cH:45][n:44][c:43]2[c:42](=[O:53])[nH:41][c:40]([NH:39][C:37]([O:36][CH2:35][c:34]3[cH:33][cH:32][c:31]([O:30][CH3:29])[cH:55][cH:54]3)=[O:38])[n:48][c:47]21)=[O:51])=[O:28]Participants
3
Sources & evidence
- ORD record
- ord-c00a0616a96d44d583c41dd22380510f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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