Ammonium → 2-(5-Amino-6-trifluoromethyl-1H-indol-2-yl)-1-ethylsulfanyl-propan-2-ol

HRID 188893

Reaction equation

[CH2:1]([CH3:2])[S:3][CH2:4][C:5]([CH3:6])([OH:7])[c:8]1[nH:9][c:10]2[cH:11][c:12]([C:20]([F:21])([F:22])[F:23])[c:13]([N+:17]([O-:18])=[O:19])[cH:14][c:15]2[cH:16]1.[CH3:27][CH2:28][OH:29].[Cl-:24].[Cl:30][CH2:31][Cl:32].[In:26].[NH4+:25]>>[CH2:1]([CH3:2])[S:3][CH2:4][C:5]([CH3:6])([OH:7])[c:8]1[nH:9][c:10]2[cH:11][c:12]([C:20]([F:21])([F:22])[F:23])[c:13]([NH2:17])[cH:14][c:15]2[cH:16]1

Participants

Reactant 6

HCID 223Ammonium

HCID 312Chloride

HCID 702Ethanol

HCID 6344Dichloromethane

HCID 5359967Indium

HCID 444311401-ethylsulfanyl-2-(5-nitro-6-trifluoromethyl-1H-indol-2-yl)-propan-2-ol

Product 1

HCID 115948662-(5-Amino-6-trifluoromethyl-1H-indol-2-yl)-1-ethylsulfanyl-propan-2-ol

Sources & evidence

ORD record: ord-06fdadf4b1564f2f99fb3bbff9c9ee1c
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

Linked notes

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