Ammonium → 1-(4-Methylbenzene-1-sulfonyl)-1H-indole-5-carbonitrile

HRID 179500Notes

Reaction equation

HRID 179500 reaction equation
[Br:4][c:5]1[cH:6][c:7]2[cH:8][cH:9][n:10]([S:14](=[O:15])(=[O:16])[c:17]3[cH:18][cH:19][c:20]([CH3:23])[cH:21][cH:22]3)[c:11]2[cH:12][cH:13]1.[C-:1]#[N:2].[CH3:24][NH:25][CH2:26][CH2:27][NH:28][CH3:29].[CH3:35][CH2:36][O:37][C:38](=[O:39])[CH3:40].[CH3:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1.[Cu:32][I:33].[NH4+:30].[Na+:3].[OH-:31].[OH2:34]>>[c:5]1([C:24]#[N:25])[cH:6][c:7]2[cH:8][cH:9][n:10]([S:14](=[O:15])(=[O:16])[c:17]3[cH:18][cH:19][c:20]([CH3:23])[cH:21][cH:22]3)[c:11]2[cH:12][cH:13]1

Participants

11

Reactant 10

HCID 223AmmoniumHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 1140TolueneHCID 5975CyanideHCID 8070N,N'-DimethylethylenediamineHCID 8857Ethyl AcetateHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 119546185-Bromo-1-(4-methylbenzene-1-sulfonyl)-1H-indole

Product 1

HCID 224925731-(4-Methylbenzene-1-sulfonyl)-1H-indole-5-carbonitrile

Sources & evidence

ORD record
ord-e13aa28808024c048c5bf5e1fa668e3d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…