Water → HCID 57864133, compound

HRID 87671Notes

Reaction equation

HRID 87671 reaction equation
[CH3:44][CH2:45][CH2:46][CH2:47][N+:48]([CH2:49][CH2:50][CH2:51][CH3:52])([CH2:53][CH2:54][CH2:55][CH3:56])[CH2:57][CH2:58][CH2:59][CH3:60].[CH3:66][N:67]([CH3:68])[CH:69]=[O:70].[CH:17]([Si:18]([CH:19]([CH3:20])[CH3:37])([S:21][c:22]1[cH:23][c:24]([C:28]2([C:34](=[O:35])[NH2:36])[CH2:29][CH2:30][O:31][CH2:32][CH2:33]2)[cH:25][cH:26][cH:27]1)[CH:38]([CH3:39])[CH3:40])([CH3:41])[CH3:42].[Cl:1][c:2]1[c:3]([C:9](=[O:10])[c:11]2[cH:12][cH:13][n:14][n:15]2[CH3:16])[cH:4][cH:5][c:6]([F:8])[cH:7]1.[F-:43].[O:61]1[CH2:62][CH2:63][CH2:64][CH2:65]1.[OH2:71]>>[Cl:1][c:2]1[c:3]([C:9](=[O:10])[c:11]2[cH:12][cH:13][n:14][n:15]2[CH3:16])[cH:4][cH:5][c:6]([S:21][c:22]2[cH:23][c:24]([C:28]3([C:34](=[O:35])[NH2:36])[CH2:29][CH2:30][O:31][CH2:32][CH2:33]3)[cH:25][cH:26][cH:27]2)[cH:7]1

Participants

8

Reactant 7

HCID 962WaterHCID 6228DimethylformamideHCID 8028TetrahydrofuranHCID 16028TetrabutylammoniumHCID 28179Fluoride IonHCID 566014104-(3-(triisopropylsilylthio)phenyl)tetrahydro-2H-pyran-4-carboxamideHCID 63961372(2-chloro-4-fluorophenyl)(1-methyl-1H-pyrazol-5-yl)methanone

Product 1

HCID 57864133HCID 57864133, compound

Sources & evidence

ORD record
ord-5559644fca78482b930b6f939038edac
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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