Methyl 3-cyclohexyl-1-methyl-2-[2-[2-[5-(methylamino)pentylamino]-2-oxoethoxy]phenyl]indole-6-carboxylate → Methyl 3-cyclohexyl-2-[4-fluoro-2-[2-[5-(methylamino)pentylamino]-2-oxoethoxy]phenyl]-1-methylindole-6-carboxylate
Reaction equation
[CH:1]1([c:2]2[c:3]3[c:4]([cH:5][c:6]([C:7]([O:8][CH3:9])=[O:10])[cH:11][cH:12]3)[n:13]([CH3:14])[c:15]2-[c:16]2[cH:17][cH:18][cH:19][cH:20][c:21]2[O:22][CH2:23][C:24]([NH:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][NH:31][CH3:32])=[O:33])[CH2:34][CH2:35][CH2:36][CH2:37][CH2:38]1.[CH:39]1([c:45]2[c:46](-[c:59]3[c:60]([O:66][CH2:67][C:68](=[O:69])[NH:70][CH2:71][CH2:72][CH2:73][CH2:74][CH2:75][N:76]([S:77]([c:78]4[cH:79][cH:80][cH:81][cH:82][c:83]4[N+:84]([O-:85])=[O:86])(=[O:87])=[O:88])[CH3:89])[cH:61][c:62]([F:65])[cH:63][cH:64]3)[n:47]([CH3:58])[c:48]3[cH:49][c:50]([C:54](=[O:55])[O:56][CH3:57])[cH:51][cH:52][c:53]23)[CH2:40][CH2:41][CH2:42][CH2:43][CH2:44]1>>[CH:39]1([c:45]2[c:46](-[c:59]3[c:60]([O:66][CH2:67][C:68](=[O:69])[NH:70][CH2:71][CH2:72][CH2:73][CH2:74][CH2:75][NH:76][CH3:89])[cH:61][c:62]([F:65])[cH:63][cH:64]3)[n:47]([CH3:58])[c:48]3[cH:49][c:50]([C:54](=[O:55])[O:56][CH3:57])[cH:51][cH:52][c:53]23)[CH2:40][CH2:41][CH2:42][CH2:43][CH2:44]1Participants
3
Reactant 2
Product 1
Sources & evidence
- ORD record
- ord-22193764d2194d61a3f9e268cc07ed8c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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