Bicarbonate Ion → 4-[(2,4-Dichloro-5-methoxyphenyl)amino]-7-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-6-methoxyquinoline-3-carbonitrile
Reaction equation
[C:64](=[O:65])([OH:66])[O-:67].[CH2:34]([CH3:35])[N:36]1[CH2:37][CH2:38][N:39]([CH2:42][c:43]2[cH:44][cH:45][c:46]([B:49]3[O:50][C:51]([CH3:52])([CH3:53])[C:54]([CH3:55])([CH3:56])[O:57]3)[cH:47][cH:48]2)[CH2:40][CH2:41]1.[CH3:58][O:59][CH2:60][CH2:61][O:62][CH3:63].[F:1][C:2]([F:3])([F:4])[S:5]([O:6][c:7]1[c:8]([O:30][CH3:31])[cH:9][c:10]2[c:11]([NH:19][c:20]3[c:21]([Cl:29])[cH:22][c:23]([Cl:28])[c:24]([O:26][CH3:27])[cH:25]3)[c:12]([C:17]#[N:18])[cH:13][n:14][c:15]2[cH:16]1)(=[O:32])=[O:33].[Na+:68].[cH:69]1[cH:70][cH:71][c:72]([P:73]([Pd:74]([P:75]([c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)([c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)[c:88]2[cH:89][cH:90][cH:91][cH:92][cH:93]2)([P:94]([c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)([c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)[c:107]2[cH:108][cH:109][cH:110][cH:111][cH:112]2)[P:113]([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)([c:132]2[cH:133][cH:134][cH:135][cH:136][cH:137]2)[c:138]2[cH:139][cH:140][cH:141][cH:142][cH:143]2)[cH:144][cH:145]1>>[c:7]1(-[c:46]2[cH:45][cH:44][c:43]([CH2:42][N:39]3[CH2:38][CH2:37][N:36]([CH2:34][CH3:35])[CH2:41][CH2:40]3)[cH:48][cH:47]2)[c:8]([O:30][CH3:31])[cH:9][c:10]2[c:11]([NH:19][c:20]3[c:21]([Cl:29])[cH:22][c:23]([Cl:28])[c:24]([O:26][CH3:27])[cH:25]3)[c:12]([C:17]#[N:18])[cH:13][n:14][c:15]2[cH:16]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-114b2552388a40858a6df71c3b0fef5c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
Loading…