Toluene → HCID 68435430, compound

HRID 1219092Notes

Reaction equation

HRID 1219092 reaction equation
[CH3:32][c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1.[Cu:39][I:40].[I:1][c:2]1[c:3]2[cH:4][cH:5][c:6]([NH:12][CH2:13][c:14]3[c:15]([O:20][CH3:21])[cH:16][cH:17][cH:18][cH:19]3)[n:7][c:8]2[cH:9][cH:10][cH:11]1.[OH:22][CH2:23][CH2:24][S:25][c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1>>[c:2]1([O:22][CH2:23][CH2:24][S:25][c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:3]2[cH:4][cH:5][c:6]([NH:12][CH2:13][c:14]3[c:15]([O:20][CH3:21])[cH:16][cH:17][cH:18][cH:19]3)[n:7][c:8]2[cH:9][cH:10][cH:11]1

Participants

5

Reactant 4

HCID 1140TolueneHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 696852-(Phenylthio)ethanolHCID 67334266HCID 67334266, compound

Product 1

HCID 68435430HCID 68435430, compound

Sources & evidence

ORD record
ord-3e81efe0482140eba7b9a0b1eaee788c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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