Sodium ion → tert-butyl 3-[4-[(5,6-difluoro-2'-oxospiro[2H-1-benzofuran-3,3'-indole]-1'-yl)methyl]anilino]pyrrolidine-1-carboxylate

HRID 2140722Notes

Reaction equation

HRID 2140722 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][N:7]2[C:8](=[O:26])[C:9]3([CH2:10][O:11][c:12]4[c:13]3[cH:14][c:15]([F:19])[c:16]([F:18])[cH:17]4)[c:20]3[cH:21][cH:22][cH:23][cH:24][c:25]32)[cH:27][cH:28]1.[C:29](=[O:30])([O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[N:36]1[CH2:37][CH:38]([NH2:41])[CH2:39][CH2:40]1.[CH3:42][C:43]([CH3:44])([O-:45])[CH3:46].[CH3:48][c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1.[Na+:47].[O:57]=[C:58]([CH:59]=[CH:60][c:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1)[CH:67]=[CH:68][c:69]1[cH:70][cH:71][cH:72][cH:73][cH:74]1.[O:75]=[C:76]([CH:77]=[CH:78][c:79]1[cH:80][cH:81][cH:82][cH:83][cH:84]1)[CH:85]=[CH:86][c:87]1[cH:88][cH:89][cH:90][cH:91][cH:92]1.[O:93]=[C:94]([CH:95]=[CH:96][c:97]1[cH:98][cH:99][cH:100][cH:101][cH:102]1)[CH:103]=[CH:104][c:105]1[cH:106][cH:107][cH:108][cH:109][cH:110]1.[Pd:55].[Pd:56]>>[c:2]1([NH:41][CH:38]2[CH2:37][N:36]([C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[CH2:40][CH2:39]2)[cH:3][cH:4][c:5]([CH2:6][N:7]2[C:8](=[O:26])[C:9]3([CH2:10][O:11][c:12]4[c:13]3[cH:14][c:15]([F:19])[c:16]([F:18])[cH:17]4)[c:20]3[cH:21][cH:22][cH:23][cH:24][c:25]32)[cH:27][cH:28]1

Participants

8

Reactant 7

HCID 923Sodium ionHCID 1140TolueneHCID 23938Palladium2×HCID 95417Dibenzylidene acetone3×HCID 27563701-Boc-3-aminopyrrolidineHCID 45749132-Methylpropan-2-olateHCID 593524831'-(4-bromobenzyl)-5,6-difluorospiro[1-benzofuran-3,3'-indol]-2'(1'H)-one

Product 1

HCID 72268638tert-butyl 3-[4-[(5,6-difluoro-2'-oxospiro[2H-1-benzofuran-3,3'-indole]-1'-yl)methyl]anilino]pyrrolidine-1-carboxylate

Sources & evidence

ORD record
ord-bd20fc9e721c4146ab983911fba64224
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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