Hydrochloric Acid → 4-Benzyl-1-{2-[3-(2-methyl-quinolin-4-yl)-ureido]-ethyl}-piperidine-4-carboxylic acid
Reaction equation
[CH2:48]1[O:49][CH2:50][CH2:51][CH2:52]1.[CH3:22][c:23]1[n:24][c:25]2[cH:26][cH:27][cH:28][cH:29][c:30]2[c:31]([NH:33][C:34](=[O:35])[NH:36][c:37]2[c:38]3[c:39]([cH:40][cH:41][cH:42][cH:43]3)[n:44][c:45]([CH3:46])[cH:47]2)[cH:32]1.[ClH:1].[ClH:2].[NH2:3][CH2:4][CH2:5][N:6]1[CH2:7][CH2:8][C:9]([C:12](=[O:13])[OH:14])([CH2:15][c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[CH2:10][CH2:11]1>>[NH:3]([CH2:4][CH2:5][N:6]1[CH2:7][CH2:8][C:9]([C:12](=[O:13])[OH:14])([CH2:15][c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[CH2:10][CH2:11]1)[C:34]([NH:33][c:31]1[c:30]2[c:25]([n:24][c:23]([CH3:22])[cH:32]1)[cH:26][cH:27][cH:28][cH:29]2)=[O:35]Participants
5
Sources & evidence
- ORD record
- ord-b53a8d86d8834e0e9be78379ea9e491b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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