Ethanol → 4-[2-(Azetidin-1-yl)ethyl]piperazine-1-carboxylic acid {4-[2-fluoro-4-(3-phenylacetylthioureido)phenoxy]pyridin-2-yl}amide
Reaction equation
[C:31]12([CH2:32][S:33]([OH:34])(=[O:35])=[O:36])[C:37]([CH3:38])([CH3:39])[CH:40]([CH2:41][CH2:42]1)[CH2:43][C:44]2=[O:45].[CH3:58][CH2:59][O:60][CH2:61][CH3:62].[CH3:63][CH2:64][OH:65].[CH3:66][c:67]1[cH:68][cH:69][cH:70][cH:71][cH:72]1.[CH3:73][CH2:74][CH2:75][CH2:76][CH2:77][CH3:78].[NH2:1][c:2]1[cH:3][c:4]([F:30])[c:5]([O:6][c:7]2[cH:8][c:9]([NH:13][C:14](=[O:15])[N:16]3[CH2:17][CH2:18][N:19]([CH2:22][CH2:23][N:24]4[CH2:25][CH2:26][CH2:27]4)[CH2:20][CH2:21]3)[n:10][cH:11][cH:12]2)[cH:28][cH:29]1.[c:46]1([CH2:52][C:53](=[O:54])[N:55]=[C:56]=[S:57])[cH:47][cH:48][cH:49][cH:50][cH:51]1>>[NH:1]([c:2]1[cH:3][c:4]([F:30])[c:5]([O:6][c:7]2[cH:8][c:9]([NH:13][C:14](=[O:15])[N:16]3[CH2:17][CH2:18][N:19]([CH2:22][CH2:23][N:24]4[CH2:25][CH2:26][CH2:27]4)[CH2:20][CH2:21]3)[n:10][cH:11][cH:12]2)[cH:28][cH:29]1)[C:56]([NH:55][C:53]([CH2:52][c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1)=[O:54])=[S:57]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-4b23611d318e4a61be1926bb40e19ec6
- Source dataset
- Validation data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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