Dimethyl Sulfoxide → HCID 72272699, compound

Reaction equation

[CH3:25][S:26]([CH3:27])=[O:28].[Cl:8][c:9]1[c:10]([C:11]#[N:12])[cH:13][cH:14][c:15]([F:18])[c:16]1[CH3:17].[Li+:19].[Li+:20].[O-:21][C:22](=[O:23])[O-:24].[OH:1][CH:2]1[CH:3]([CH3:7])[NH:4][CH2:5][CH2:6]1>>[OH:1][CH:2]1[CH:3]([CH3:7])[N:4]([c:15]2[cH:14][cH:13][c:10]([C:11]#[N:12])[c:9]([Cl:8])[c:16]2[CH3:17])[CH2:5][CH2:6]1

Participants

Reactant 5

HCID 679Dimethyl Sulfoxide

HCID 19660Carbonate Ion

HCID 28486Lithium Cation2×

HCID 224758632-Methylpyrrolidin-3-ol

HCID 445509712-Chloro-4-fluoro-3-methylbenzonitrile

Product 1

HCID 72272699HCID 72272699, compound

Sources & evidence

ORD record: ord-c698f37878ef46ec810cc3117ce7c7ac
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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