Potassium Cation → 2-Chloro-4,4-difluoro-1'-[[1-(3-methoxy-2-pyridyl)-3-methyl-pyrazol-4-yl]methyl]spiro[5H-thieno[2,3-c]pyran-7,4'-piperidine]

HRID 2332174Notes

Reaction equation

HRID 2332174 reaction equation
[C:25](=[O:26])([O-:27])[O-:28].[CH3:40][NH:41][CH:42]1[CH2:43][CH2:44][CH2:45][CH2:46][CH:47]1[NH:48][CH3:49].[CH3:52][c:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1.[Cl:1][c:2]1[cH:3][c:4]2[c:5]([s:24]1)[C:6]1([O:7][CH2:8][C:9]2([F:10])[F:11])[CH2:12][CH2:13][N:14]([CH2:17][c:18]2[c:19]([CH3:23])[n:20][nH:21][cH:22]2)[CH2:15][CH2:16]1.[Cu:50][I:51].[I:31][c:32]1[n:33][cH:34][cH:35][cH:36][c:37]1[O:38][CH3:39].[K+:29].[K+:30]>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]([s:24]1)[C:6]1([O:7][CH2:8][C:9]2([F:10])[F:11])[CH2:12][CH2:13][N:14]([CH2:17][c:18]2[c:19]([CH3:23])[n:20][n:21](-[c:32]3[n:33][cH:34][cH:35][cH:36][c:37]3[O:38][CH3:39])[cH:22]2)[CH2:15][CH2:16]1

Participants

8

Reactant 7

HCID 813Potassium Cation2×HCID 1140TolueneHCID 19660Carbonate IonHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 5510741-N,2-N-dimethylcyclohexane-1,2-diamineHCID 8171732-Iodo-3-methoxypyridineHCID 178434546HCID 178434546, compound

Product 1

HCID 582686102-Chloro-4,4-difluoro-1'-[[1-(3-methoxy-2-pyridyl)-3-methyl-pyrazol-4-yl]methyl]spiro[5H-thieno[2,3-c]pyran-7,4'-piperidine]

Sources & evidence

ORD record
ord-8670a038a462443794ead10ae5fa674f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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