Acetic Acid → 1-{2-[1-(4-Fluoro-benzyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-ethyl}-3-(5,6,7,8-tetrahydro-quinolin-4-yl)-urea
Reaction equation
[C:1]([CH3:3])([CH3:4])([O:5][C:6](=[O:2])[NH:7][CH2:8][CH2:9][N:10]1[CH:11]([CH2:24][c:25]2[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]2)[c:12]2[cH:13][c:14]([O:22][CH3:23])[c:15]([O:20][CH3:21])[cH:16][c:17]2[CH2:18][CH2:19]1)[CH3:32].[C:34]([n:35]1[cH:36][cH:37][n:38][cH:39]1)([n:40]1[cH:41][cH:42][n:43][cH:44]1)=[O:45].[C:67]([OH:68])(=[O:69])[CH3:70].[CH3:58][Si:59]([N-:60][Si:61]([CH3:62])([CH3:63])[CH3:64])([CH3:65])[CH3:66].[ClH:33].[NH2:46][c:47]1[cH:48][cH:49][n:50][c:51]2[c:56]1[CH2:55][CH2:54][CH2:53][CH2:52]2.[Na+:57].[OH2:71]>>[O:5]=[C:6]([NH:7][CH2:8][CH2:9][N:10]1[CH:11]([CH2:24][c:25]2[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]2)[c:12]2[cH:13][c:14]([O:22][CH3:23])[c:15]([O:20][CH3:21])[cH:16][c:17]2[CH2:18][CH2:19]1)[NH:46][c:47]1[cH:48][cH:49][n:50][c:51]2[c:56]1[CH2:55][CH2:54][CH2:53][CH2:52]2Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-19437c00891e4191bb36db8f02720b88
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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