Potassium Cation → 2-Nitro-5-(naphth-2-ylthio)benzonitrile

HRID 314514

Reaction equation

HRID 314514 reaction equation
[C:24](=[O:25])([O-:26])[O-:27].[CH3:36][N:37]([CH3:38])[CH:39]=[O:40].[Cl:1][c:2]1[cH:3][cH:4][c:5]([N+:10](=[O:11])[O-:12])[c:6]([C:7]#[N:8])[cH:9]1.[K+:28].[K+:29].[OH2:41].[cH:13]1[c:14]([SH:23])[cH:15][cH:16][c:17]2[cH:18][cH:19][cH:20][cH:21][c:22]12.[cH:30]1[cH:31][cH:32][n:33][cH:34][cH:35]1>>[c:2]1([S:23][c:14]2[cH:13][c:22]3[c:17]([cH:16][cH:15]2)[cH:18][cH:19][cH:20][cH:21]3)[cH:3][cH:4][c:5]([N+:10](=[O:11])[O-:12])[c:6]([C:7]#[N:8])[cH:9]1

Participants

8

Reactant 7

HCID 813Potassium Cation2×HCID 962WaterHCID 1049PyridineHCID 6228DimethylformamideHCID 70582-NaphthalenethiolHCID 19660Carbonate IonHCID 1005065-Chloro-2-nitrobenzonitrile

Product 1

HCID 542131652-Nitro-5-(naphth-2-ylthio)benzonitrile

Sources & evidence

ORD record
ord-e797302b94e64a1ead5e5d170ffec6bf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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