Sodium ion → 3,5-Dichloro-4-(5-trifluoromethyl-benzothiazol-2-ylsulfanyl)phenylamine

HRID 297316Notes

Reaction equation

[CH3:35][CH2:36][O:37][C:38]([CH3:39])=[O:40].[Cl:1][c:2]1[c:3]([S:12][c:13]2[s:14][c:15]3[c:16]([n:17]2)[cH:18][c:19]([C:22]([F:23])([F:24])[F:25])[cH:20][cH:21]3)[c:4]([Cl:11])[cH:5][c:6]([N+:8]([O-:9])=[O:10])[cH:7]1.[Na+:34].[OH-:33].[OH2:26].[OH2:27].[Sn:28]([Cl:29])([Cl:30])([Cl:31])[Cl:32]>>[Cl:1][c:2]1[c:3]([S:12][c:13]2[s:14][c:15]3[c:16]([n:17]2)[cH:18][c:19]([C:22]([F:23])([F:24])[F:25])[cH:20][cH:21]3)[c:4]([Cl:11])[cH:5][c:6]([NH2:8])[cH:7]1

Participants

Reactant 6

HCID 923Sodium ion

HCID 961Hydroxide

HCID 962Water2×

HCID 8857Ethyl Acetate

HCID 24287Tin tetrachloride

HCID 221488312-(2,6-Dichloro-4-nitro-phenylsulfanyl)-5-trifluoromethyl-benzothiazole

Product 1

HCID 221488813,5-Dichloro-4-(5-trifluoromethyl-benzothiazol-2-ylsulfanyl)phenylamine

Sources & evidence

ORD record: ord-bb2f464d74cf4387b37b0662b80c6205
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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