Sodium ion → HCID 18318524, compound

HRID 320006Notes

Reaction equation

HRID 320006 reaction equation
[H-:1].[N:12]1([CH2:17][CH2:18][O:19][c:20]2[cH:21][cH:22][c:23](-[c:26]3[c:27]([C:35](=[O:36])[c:37]4[cH:38][cH:39][c:40]([F:43])[cH:41][cH:42]4)[c:28]4[c:29]([s:30]3)[cH:31][cH:32][cH:33][cH:34]4)[cH:24][cH:25]2)[CH2:13][CH2:14][CH2:15][CH2:16]1.[Na+:2].[O:44]=[CH:45][N:46]([CH3:47])[CH3:48].[OH:3][CH2:4][CH2:5][N:6]1[C:7](=[O:11])[CH2:8][CH2:9][CH2:10]1>>[O:3]([CH2:4][CH2:5][N:6]1[C:7](=[O:11])[CH2:8][CH2:9][CH2:10]1)[c:40]1[cH:39][cH:38][c:37]([C:35]([c:27]2[c:26](-[c:23]3[cH:22][cH:21][c:20]([O:19][CH2:18][CH2:17][N:12]4[CH2:13][CH2:14][CH2:15][CH2:16]4)[cH:25][cH:24]3)[s:30][c:29]3[c:28]2[cH:34][cH:33][cH:32][cH:31]3)=[O:36])[cH:42][cH:41]1

Participants

6

Reactant 5

HCID 923Sodium ionHCID 6228DimethylformamideHCID 769801-(2-Hydroxyethyl)-2-pyrrolidinoneHCID 166653HydrideHCID 107182054-Fluorophenyl 2-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]benzo[b]thiophen-3-yl ketone

Product 1

HCID 18318524HCID 18318524, compound

Sources & evidence

ORD record
ord-1c43cb7c23ab4313a0672e31f1d415fa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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