Potassium Cation → 2-[2-(3-Piperidin-1-ylpyrrolidin-1-yl)-1,3-benzothiazol-6-yl]pyridazin-3-one

HRID 1214975

Reaction equation

HRID 1214975 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5]([n:6][c:7]([N:9]3[CH2:10][CH:11]([N:14]4[CH2:15][CH2:16][CH2:17][CH2:18][CH2:19]4)[CH2:12][CH2:13]3)[s:8]2)[cH:20][cH:21]1.[C:29](=[O:30])([O-:31])[O-:32].[CH3:35][NH:36][CH2:37][CH2:38][NH:39][CH3:40].[CH3:44][CH2:45][O:46][CH2:47][CH3:48].[CH3:49][c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1.[Cu:41].[Cu:42][I:43].[K+:33].[K+:34].[cH:56]1[cH:57][cH:58][n:59][cH:60][cH:61]1.[n:22]1[nH:23][c:24](=[O:28])[cH:25][cH:26][cH:27]1>>[c:2]1(-[n:23]2[n:22][cH:27][cH:26][cH:25][c:24]2=[O:28])[cH:3][c:4]2[c:5]([n:6][c:7]([N:9]3[CH2:10][CH:11]([N:14]4[CH2:15][CH2:16][CH2:17][CH2:18][CH2:19]4)[CH2:12][CH2:13]3)[s:8]2)[cH:20][cH:21]1

Participants

11

Reactant 10

HCID 813Potassium Cation2×HCID 1049PyridineHCID 1140TolueneHCID 3283Diethyl EtherHCID 8070N,N'-DimethylethylenediamineHCID 19660Carbonate IonHCID 23978CopperHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 681533(2H)-PyridazinoneHCID 669061216-Bromo-2-(3-piperidin-1-ylpyrrolidin-1-yl)-1,3-benzothiazole

Product 1

HCID 669057212-[2-(3-Piperidin-1-ylpyrrolidin-1-yl)-1,3-benzothiazol-6-yl]pyridazin-3-one

Sources & evidence

ORD record
ord-91aa0bbee6f842b5b6686b138a83d47d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Linked notes

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