3-Fluoro-4-(2-(4-(methylsulfonyl)phenyl)thieno[3,2-b]pyridin-7-yloxy)benzenamine → tert-Butyl 4-(4-(7-(2-fluoro-4-(3-(2-phenylacetyl)thioureido)phenoxy)thieno[3,2-b]pyridine-2-yl)phenyl)piperazine-1-carboxylate
Reaction equation
[F:1][c:2]1[cH:3][c:4]([NH:28][C:29](=[S:30])[NH:31][C:32]([CH2:33][c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)=[O:40])[cH:5][cH:6][c:7]1[O:8][c:9]1[c:10]2[c:11]([n:12][cH:13][cH:14]1)[cH:15][c:16](-[c:18]1[cH:19][cH:20][c:21]([S:24]([CH3:25])(=[O:26])=[O:27])[cH:22][cH:23]1)[s:17]2.[F:41][c:42]1[cH:43][c:44]([NH2:45])[cH:46][cH:47][c:48]1[O:49][c:50]1[cH:51][cH:52][n:53][c:54]2[cH:55][c:56](-[c:57]3[cH:58][cH:59][c:60]([S:61]([CH3:62])(=[O:63])=[O:64])[cH:65][cH:66]3)[s:67][c:68]12.[NH2:69][c:70]1[cH:71][cH:72][c:73]([O:74][c:75]2[cH:76][cH:77][n:78][c:79]3[cH:80][c:81](-[c:82]4[cH:83][cH:84][c:85]([N:90]5[CH2:91][CH2:92][N:93]([C:96](=[O:97])[O:98][C:99]([CH3:100])([CH3:101])[CH3:102])[CH2:94][CH2:95]5)[cH:86][cH:87]4)[s:88][c:89]23)[c:103]([F:104])[cH:105]1>>[F:1][c:2]1[cH:3][c:4]([NH:28][C:29](=[S:30])[NH:31][C:32]([CH2:33][c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)=[O:40])[cH:5][cH:6][c:7]1[O:8][c:9]1[c:10]2[c:11]([n:12][cH:13][cH:14]1)[cH:15][c:16](-[c:18]1[cH:19][cH:20][c:21]([N:90]3[CH2:91][CH2:92][N:93]([C:96](=[O:97])[O:98][C:99]([CH3:100])([CH3:101])[CH3:102])[CH2:94][CH2:95]3)[cH:22][cH:23]1)[s:17]2Participants
4
Reactant 3
HCID 587728693-Fluoro-4-(2-(4-(methylsulfonyl)phenyl)thieno[3,2-b]pyridin-7-yloxy)benzenamine
HCID 58772875N-(3-Fluoro-4-(2-(4-(methylsulfonyl)phenyl)thieno[3,2-b]pyridin-7-yloxy)phenylcarbamothioyl)-2-phenylacetamide
HCID 59424580tert-Butyl 4-(4-(7-(4-amino-2-fluorophenoxy)thieno[3,2-b]pyridin-2-yl)phenyl)piperazine-1-carboxylateProduct 1
Sources & evidence
- ORD record
- ord-e8bcc833996549969759945811c9e0aa
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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