Dimethyl Sulfoxide → (4-Cyano-5-diethylamino-2-nitro-phenyl)-carbamic acid tert-butyl ester

Reaction equation

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([N+:17](=[O:18])[O-:19])[cH:10][c:11]([C:15]#[N:16])[c:12]([F:14])[cH:13]1)=[O:20].[CH2:21]([CH3:22])[NH:23][CH2:24][CH3:25].[CH3:26][S:27]([CH3:28])=[O:29]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([N+:17](=[O:18])[O-:19])[cH:10][c:11]([C:15]#[N:16])[c:12]([N:23]([CH2:21][CH3:22])[CH2:24][CH3:25])[cH:13]1)=[O:20]

Participants

Reactant 3

HCID 679Dimethyl Sulfoxide

HCID 8021Diethylamine

HCID 696872744-(Boc-amino)-2-fluoro-5-nitrobenzonitrile

Product 1

HCID 69688996(4-Cyano-5-diethylamino-2-nitro-phenyl)-carbamic acid tert-butyl ester

Sources & evidence

ORD record: ord-a8d806e876c447d38bc70bff12868b85
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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