Sodium ion → 4-(2,4-Dimethoxy-benzylamino)-2-fluoro-N-thiazol-2-yl-benzenesulfonamide

HRID 2323758Notes

Reaction equation

HRID 2323758 reaction equation
[Br:1][c:2]1[cH:3][c:4]([F:17])[c:5]([S:8](=[O:9])(=[O:10])[NH:11][c:12]2[s:13][cH:14][cH:15][n:16]2)[cH:6][cH:7]1.[CH2:66]1[O:67][CH2:68][CH2:69][O:70][CH2:71]1.[CH3:18][C:19]([CH3:20])([O-:21])[CH3:22].[CH3:24][C:25]1([CH3:26])[c:27]2[cH:28][cH:29][cH:30][c:31]([P:32]([c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[c:39]3[cH:40][cH:41][cH:42][cH:43][cH:44]3)[c:45]2[O:46][c:47]2[c:48]1[cH:49][cH:50][cH:51][c:52]2[P:53]([c:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1)[c:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1.[CH3:72][O:73][c:74]1[c:75]([CH2:76][NH2:77])[cH:78][cH:79][c:80]([O:82][CH3:83])[cH:81]1.[Na+:23].[O:104]=[C:105]([CH:106]=[CH:107][c:108]1[cH:109][cH:110][cH:111][cH:112][cH:113]1)[CH:114]=[CH:115][c:116]1[cH:117][cH:118][cH:119][cH:120][cH:121]1.[O:122]=[C:123]([CH:124]=[CH:125][c:126]1[cH:127][cH:128][cH:129][cH:130][cH:131]1)[CH:132]=[CH:133][c:134]1[cH:135][cH:136][cH:137][cH:138][cH:139]1.[O:86]=[C:87]([CH:88]=[CH:89][c:90]1[cH:91][cH:92][cH:93][cH:94][cH:95]1)[CH:96]=[CH:97][c:98]1[cH:99][cH:100][cH:101][cH:102][cH:103]1.[Pd:84].[Pd:85]>>[c:2]1([NH:77][CH2:76][c:75]2[c:74]([O:73][CH3:72])[cH:81][c:80]([O:82][CH3:83])[cH:79][cH:78]2)[cH:3][c:4]([F:17])[c:5]([S:8](=[O:9])(=[O:10])[NH:11][c:12]2[s:13][cH:14][cH:15][n:16]2)[cH:6][cH:7]1

Participants

9

Reactant 8

HCID 923Sodium ionHCID 23938Palladium2×HCID 312751,4-DioxaneHCID 95417Dibenzylidene acetone3×HCID 5972502,4-DimethoxybenzylamineHCID 6360441,1'-(9,9-Dimethyl-9H-xanthene-4,5-diyl)bis(1,1-diphenylphosphine)HCID 45749132-Methylpropan-2-olateHCID 251383534-Bromo-2-fluoro-N-thiazol-2-yl-benzenesulfonamide

Product 1

HCID 575512544-(2,4-Dimethoxy-benzylamino)-2-fluoro-N-thiazol-2-yl-benzenesulfonamide

Sources & evidence

ORD record
ord-cdef621f0fb9483c9cb62385f4d38e0e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

Loading…