Potassium Cation → 4-{3-[2-(Benzhydrylidene-amino)-4-(4-fluoro-phenyl)-quinolin-7-ylsulfanyl]-phenyl}-tetrahydro-pyran-4-carbonitrile
Reaction equation
[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)=[N:14][c:15]1[n:16][c:17]2[cH:18][c:19]([S:26][c:27]3[cH:28][c:29]([C:33]4([C:39]#[N:40])[CH2:34][CH2:35][O:36][CH2:37][CH2:38]4)[cH:30][cH:31][cH:32]3)[cH:20][cH:21][c:22]2[c:23]([Cl:25])[cH:24]1.[C:51](=[O:52])([O-:53])[O-:54].[F:41][c:42]1[cH:43][cH:44][c:45]([B:48]([OH:49])[OH:50])[cH:46][cH:47]1.[K+:55].[K+:56].[cH:57]1[cH:58][cH:59][c:60]([P:61]([Pd:62]([P:63]([c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)([c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)[c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)([P:82]([c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)([c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)[c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[P:101]([c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)([c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)[c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)([c:120]2[cH:121][cH:122][cH:123][cH:124][cH:125]2)[c:126]2[cH:127][cH:128][cH:129][cH:130][cH:131]2)[cH:132][cH:133]1>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)=[N:14][c:15]1[n:16][c:17]2[cH:18][c:19]([S:26][c:27]3[cH:28][c:29]([C:33]4([C:39]#[N:40])[CH2:34][CH2:35][O:36][CH2:37][CH2:38]4)[cH:30][cH:31][cH:32]3)[cH:20][cH:21][c:22]2[c:23](-[c:45]2[cH:44][cH:43][c:42]([F:41])[cH:47][cH:46]2)[cH:24]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-56e9d4a2107547f8807e1d020789b9b6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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