Water → N-(2-chloro-5-(2-(methylamino)benzo[d]thiazol-6-yl)pyridin-3-yl)-4-fluorobenzenesulfonamide

HRID 1152119Notes

Reaction equation

HRID 1152119 reaction equation
[Br:27][c:28]1[cH:29][c:30]([NH:35][S:36](=[O:37])(=[O:38])[c:39]2[cH:40][cH:41][c:42]([F:45])[cH:43][cH:44]2)[c:31]([Cl:34])[n:32][cH:33]1.[C:21](=[O:22])([O-:23])[O-:24].[CH2:46]1[O:47][CH2:48][CH2:49][CH2:50]1.[CH3:1][NH:2][c:3]1[s:4][c:5]2[c:6]([n:7]1)[cH:8][cH:9][c:10]([B:12]1[O:13][C:14]([CH3:15])([CH3:16])[C:17]([CH3:18])([CH3:19])[O:20]1)[cH:11]2.[Cs+:25].[Cs+:26].[OH2:51]>>[CH3:1][NH:2][c:3]1[s:4][c:5]2[c:6]([n:7]1)[cH:8][cH:9][c:10](-[c:28]1[cH:29][c:30]([NH:35][S:36](=[O:37])(=[O:38])[c:39]3[cH:40][cH:41][c:42]([F:45])[cH:43][cH:44]3)[c:31]([Cl:34])[n:32][cH:33]1)[cH:11]2

Participants

7

Reactant 6

HCID 962WaterHCID 8028TetrahydrofuranHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 53363354N-(5-bromo-2-chloropyridin-3-yl)-4-fluorobenzenesulfonamideHCID 58279591N-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[d]thiazol-2-amine

Product 1

HCID 57585117N-(2-chloro-5-(2-(methylamino)benzo[d]thiazol-6-yl)pyridin-3-yl)-4-fluorobenzenesulfonamide

Sources & evidence

ORD record
ord-679a1a24472b4c539554382ee51ee801
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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