3-Aminopropionitrile → 4-(4-(3-Ethylureido)-3-fluoro-phenoxy)-7-methoxyquinoline-6-carboxylic acid (2-cyanoethyl)amide
Reaction equation
[C:30](#[N:31])[CH2:32][CH2:33][NH2:34].[CH2:1]([CH3:2])[NH:3][C:4]([NH:5][c:6]1[c:7]([F:28])[cH:8][c:9]([O:10][c:11]2[cH:12][cH:13][n:14][c:15]3[cH:16][c:17]([O:24][CH3:25])[c:18]([C:21](=[O:22])[OH:23])[cH:19][c:20]23)[cH:26][cH:27]1)=[O:29].[CH3:62][CH2:63][N:64]([CH2:65][CH3:66])[CH2:67][CH3:68].[P-:35]([F:36])([F:37])([F:38])([F:39])([F:40])[F:41].[n:42]1([O:43][P+:44]([N:45]([CH3:46])[CH3:47])([N:48]([CH3:49])[CH3:50])[N:51]([CH3:52])[CH3:53])[c:54]2[cH:55][cH:56][cH:57][cH:58][c:59]2[n:60][n:61]1>>[CH2:1]([CH3:2])[NH:3][C:4]([NH:5][c:6]1[c:7]([F:28])[cH:8][c:9]([O:10][c:11]2[cH:12][cH:13][n:14][c:15]3[cH:16][c:17]([O:24][CH3:25])[c:18]([C:21](=[O:23])[NH:34][CH2:33][CH2:32][C:30]#[N:31])[cH:19][c:20]23)[cH:26][cH:27]1)=[O:29]Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-297fbc9cd3b348e9802685a1269cd4f0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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