Toluene → HCID 54027528, compound

HRID 214002Notes

Reaction equation

HRID 214002 reaction equation
[CH3:26][O:27][CH:28]([CH2:29][NH:30][CH3:31])[O:32][CH3:33].[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[c:1]1([S:7](=[O:8])[c:9]2[c:10]([O:21][CH2:22][CH2:23][CH2:24][CH3:25])[cH:11][c:12]([NH:15][C:16]([O:17][CH2:18][CH3:19])=[O:20])[cH:13][cH:14]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([S:7](=[O:8])[c:9]2[c:10]([O:21][CH2:22][CH2:23][CH2:24][CH3:25])[cH:11][c:12]([NH:15][C:16](=[O:20])[N:30]([CH2:29][CH:28]([O:27][CH3:26])[O:32][CH3:33])[CH3:31])[cH:13][cH:14]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 85032,2-DimethoxyethylmethylamineHCID 54254344HCID 54254344, compound

Product 1

HCID 54027528HCID 54027528, compound

Sources & evidence

ORD record
ord-e4f3a5534d664cd899972021dbd8b9f3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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