Ethanol → HCID 15816945, compound

HRID 2143362Notes

Reaction equation

HRID 2143362 reaction equation
[CH3:40][CH2:41][OH:42].[CH3:43][C:44]#[N:45].[F:1][c:2]1[cH:3][c:4]2[c:5]([c:6]([CH:9]3[CH2:10][CH2:11][NH:12][CH2:13][CH2:14]3)[n:7][o:8]2)[cH:15][cH:16]1.[K+:17].[K+:18].[O-:19][C:20]([O-:21])=[O:22].[S:23]([O:24][CH2:28][CH2:29][CH:30]1[CH2:31][O:32][c:33]2[c:34]([cH:36][cH:37][cH:38][cH:39]2)[O:35]1)([CH3:25])(=[O:26])=[O:27]>>[F:1][c:2]1[cH:3][c:4]2[c:5]([c:6]([CH:9]3[CH2:10][CH2:11][N:12]([CH2:28][CH2:29][CH:30]4[CH2:31][O:32][c:33]5[c:34]([cH:36][cH:37][cH:38][cH:39]5)[O:35]4)[CH2:13][CH2:14]3)[n:7][o:8]2)[cH:15][cH:16]1

Participants

7

Reactant 6

HCID 702EthanolHCID 813Potassium Cation2×HCID 6342AcetonitrileHCID 19660Carbonate IonHCID 8494213-(4-Piperidyl)-6-fluoro-1,2-benzisoxazoleHCID 153801072-Mesyloxyethyl-1,4-benzodioxan

Product 1

HCID 15816945HCID 15816945, compound

Sources & evidence

ORD record
ord-60b3ceadcbed4e98b9129bfd98381475
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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