3-(Chloromethyl)-5-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole → 1'-({5-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}methyl)spiro[furo[2,3-f][1,3]benzodioxole-7,3'-indol]-2'(1'H)-one

HRID 289014

Reaction equation

HRID 289014 reaction equation
[Br:22][c:23]1[cH:24][cH:25][cH:26][c:27]2[c:43]1[C:31]1([C:29](=[O:30])[NH:28]2)[c:32]2[cH:33][c:34]3[c:38]([cH:39][c:40]2[O:41][CH2:42]1)[O:37][CH2:36][O:35]3.[Br:61][CH2:62][c:63]1[o:64][c:65]([C:66]([F:67])([F:68])[F:69])[cH:70][cH:71]1.[Cl:44][CH2:45][c:46]1[n:47][o:48][c:49](-[c:51]2[cH:52][cH:53][c:54]([C:57]([F:58])([F:59])[F:60])[cH:55][cH:56]2)[n:50]1.[NH:1]1[C:2](=[O:21])[C:3]2([CH2:4][O:5][c:6]3[c:7]2[cH:8][c:9]2[c:10]([cH:14]3)[O:11][CH2:12][O:13]2)[c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]21>>[N:1]1([CH2:45][c:46]2[n:47][o:48][c:49](-[c:51]3[cH:52][cH:53][c:54]([C:57]([F:58])([F:59])[F:60])[cH:55][cH:56]3)[n:50]2)[C:2](=[O:21])[C:3]2([CH2:4][O:5][c:6]3[c:7]2[cH:8][c:9]2[c:10]([cH:14]3)[O:11][CH2:12][O:13]2)[c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]21

Participants

5

Reactant 4

HCID 27366243-(Chloromethyl)-5-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazoleHCID 27946052-(Bromomethyl)-5-(trifluoromethyl)furanHCID 53375495spiro[furo[2,3-f][1,3]benzodioxole-7,3'-indol]-2'(1'H)-oneHCID 592633724'-bromospiro[furo[2,3-f][1,3]benzodioxole-7,3'-indol]-2'(1H)-one

Product 1

HCID 592633901'-({5-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}methyl)spiro[furo[2,3-f][1,3]benzodioxole-7,3'-indol]-2'(1'H)-one

Sources & evidence

ORD record
ord-54e12fa0d035479984798e9fc3803854
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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