Diisopropyl Ether → ethyl 3-(4-{(4-{4-[2-(ethylthio)ethoxy]-2,6-dimethylphenyl}-2,3-dihydro-1H-inden-1-yl)[(2-nitrophenyl)sulfonyl]amino}-2-fluorophenyl)propanoate
Reaction equation
[CH2:46]([CH3:47])[S:48][CH2:49][CH2:50][OH:51].[CH2:52]([P:53]([CH2:54][CH2:55][CH2:56][CH3:57])[CH2:58][CH2:59][CH2:60][CH3:61])[CH2:62][CH2:63][CH3:64].[CH:88]([O:89][CH:90]([CH3:91])[CH3:92])([CH3:93])[CH3:94].[F:1][c:2]1[c:3]([CH2:39][CH2:40][C:41](=[O:42])[O:43][CH2:44][CH3:45])[cH:4][cH:5][c:6]([N:8]([S:9](=[O:10])(=[O:11])[c:12]2[c:13]([N+:18](=[O:19])[O-:20])[cH:14][cH:15][cH:16][cH:17]2)[CH:21]2[CH2:22][CH2:23][c:24]3[c:25](-[c:30]4[c:31]([CH3:38])[cH:32][c:33]([OH:37])[cH:34][c:35]4[CH3:36])[cH:26][cH:27][cH:28][c:29]32)[cH:7]1.[N:65]([C:66]([N:67]1[CH2:68][CH2:69][CH2:70][CH2:71][CH2:72]1)=[O:73])=[N:74][C:75]([N:76]1[CH2:77][CH2:78][CH2:79][CH2:80][CH2:81]1)=[O:82].[O:83]1[CH2:84][CH2:85][CH2:86][CH2:87]1>>[F:1][c:2]1[c:3]([CH2:39][CH2:40][C:41](=[O:42])[O:43][CH2:44][CH3:45])[cH:4][cH:5][c:6]([N:8]([S:9](=[O:10])(=[O:11])[c:12]2[c:13]([N+:18](=[O:19])[O-:20])[cH:14][cH:15][cH:16][cH:17]2)[CH:21]2[CH2:22][CH2:23][c:24]3[c:25](-[c:30]4[c:31]([CH3:38])[cH:32][c:33]([O:37][CH2:50][CH2:49][S:48][CH2:46][CH3:47])[cH:34][c:35]4[CH3:36])[cH:26][cH:27][cH:28][c:29]32)[cH:7]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-df2578632e054d8396f8993a1f26ce74
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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