Water → 1-(3-Chloro-benzyl)-7-(2-chloro-ethoxy)-5-fluoro-3-(naphthalene-1-sulfonyl)-1H-indazole

HRID 1113719Notes

Reaction equation

HRID 1113719 reaction equation
[C:37](=[O:38])([O-:39])[O-:40].[Cl:1][CH2:2][CH2:3][O:4][c:5]1[cH:6][c:7]([F:27])[cH:8][c:9]2[c:10]([S:14](=[O:15])(=[O:16])[c:17]3[cH:18][cH:19][cH:20][c:21]4[cH:22][cH:23][cH:24][cH:25][c:26]34)[n:11][nH:12][c:13]12.[Cl:28][c:29]1[cH:30][c:31]([CH2:32][Br:33])[cH:34][cH:35][cH:36]1.[Cs+:41].[Cs+:42].[O:43]=[CH:44][N:45]([CH3:46])[CH3:47].[OH2:48]>>[Cl:1][CH2:2][CH2:3][O:4][c:5]1[cH:6][c:7]([F:27])[cH:8][c:9]2[c:10]([S:14](=[O:15])(=[O:16])[c:17]3[cH:18][cH:19][cH:20][c:21]4[cH:22][cH:23][cH:24][cH:25][c:26]34)[n:11][n:12]([CH2:32][c:31]3[cH:30][c:29]([Cl:28])[cH:36][cH:35][cH:34]3)[c:13]12

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 698381-(Bromomethyl)-3-chlorobenzeneHCID 104967Cesium cation2×HCID 178527288HCID 178527288, compound

Product 1

HCID 588121191-(3-Chloro-benzyl)-7-(2-chloro-ethoxy)-5-fluoro-3-(naphthalene-1-sulfonyl)-1H-indazole

Sources & evidence

ORD record
ord-37e16e27c8b744dbb6637eac3f8fe0f8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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