Chloroform → 3-Methanesulfonyl-2-methyl-6-morpholin-4-yl-4-(4-trifluoromethyl-phenyl)-quinoline

HRID 1219998Notes

Reaction equation

HRID 1219998 reaction equation
[Br:41][c:42]1[cH:43][c:44]2[c:45](-[c:57]3[cH:58][cH:59][c:60]([C:63]([F:64])([F:65])[F:66])[cH:61][cH:62]3)[c:46]([S:53](=[O:54])(=[O:55])[CH3:56])[c:47]([CH3:52])[n:48][c:49]2[cH:50][cH:51]1.[C:35](=[O:36])([O-:37])[O-:38].[C:73]([OH:74])([CH3:75])([CH3:76])[CH3:77].[CH2:67]1[CH2:68][O:69][CH2:70][CH2:71][NH:72]1.[CH3:78][CH2:79][CH2:80][CH2:81][CH2:82][CH2:83][CH3:84].[CH:141]([Cl:142])([Cl:143])[Cl:144].[CH:1]1([P:2]([CH:3]2[CH2:4][CH2:5][CH2:6][CH2:7][CH2:8]2)[c:9]2[cH:10][cH:11][cH:12][cH:13][c:14]2-[c:15]2[c:16]([CH:17]([CH3:18])[CH3:19])[cH:20][c:21]([CH:22]([CH3:23])[CH3:24])[cH:25][c:26]2[CH:27]([CH3:28])[CH3:29])[CH2:30][CH2:31][CH2:32][CH2:33][CH2:34]1.[Cs+:39].[Cs+:40].[O:105]=[C:106]([CH:107]=[CH:108][c:109]1[cH:110][cH:111][cH:112][cH:113][cH:114]1)[CH:115]=[CH:116][c:117]1[cH:118][cH:119][cH:120][cH:121][cH:122]1.[O:123]=[C:124]([CH:125]=[CH:126][c:127]1[cH:128][cH:129][cH:130][cH:131][cH:132]1)[CH:133]=[CH:134][c:135]1[cH:136][cH:137][cH:138][cH:139][cH:140]1.[O:87]=[C:88]([CH:89]=[CH:90][c:91]1[cH:92][cH:93][cH:94][cH:95][cH:96]1)[CH:97]=[CH:98][c:99]1[cH:100][cH:101][cH:102][cH:103][cH:104]1.[Pd:85].[Pd:86]>>[c:42]1([N:72]2[CH2:67][CH2:68][O:69][CH2:70][CH2:71]2)[cH:43][c:44]2[c:45](-[c:57]3[cH:58][cH:59][c:60]([C:63]([F:64])([F:65])[F:66])[cH:61][cH:62]3)[c:46]([S:53](=[O:54])(=[O:55])[CH3:56])[c:47]([CH3:52])[n:48][c:49]2[cH:50][cH:51]1

Participants

11

Reactant 10

HCID 6212ChloroformHCID 6386tert-ButanolHCID 8083MorpholineHCID 8900HeptaneHCID 19660Carbonate IonHCID 23938Palladium2×HCID 95417Dibenzylidene acetone3×HCID 104967Cesium cation2×HCID 111557942-Dicyclohexylphosphino-2',4',6'-triisoprophylbiphenylHCID 120017256-Bromo-3-methanesulfonyl-2-methyl-4-(4-trifluoromethyl-phenyl)-quinoline

Product 1

HCID 120017233-Methanesulfonyl-2-methyl-6-morpholin-4-yl-4-(4-trifluoromethyl-phenyl)-quinoline

Sources & evidence

ORD record
ord-ea89ec4296b949799c9be27ff368247e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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