Acetonitrile → N'-[3-(Diethylamino)propyl]-N-(1-methylethyl)-N-[2-(phenylsulfonyl)ethyl]thiourea

HRID 94203

Reaction equation

HRID 94203 reaction equation
[CH2:16]([CH3:17])[N:18]([CH2:19][CH3:20])[CH2:21][CH2:22][CH2:23][N:24]=[C:25]=[S:26].[CH3:27][C:28]#[N:29].[c:1]1([S:7](=[O:8])(=[O:9])[CH2:10][CH2:11][NH:12][CH:13]([CH3:14])[CH3:15])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([S:7](=[O:8])(=[O:9])[CH2:10][CH2:11][N:12]([CH:13]([CH3:14])[CH3:15])[C:25]([NH:24][CH2:23][CH2:22][CH2:21][N:18]([CH2:16][CH3:17])[CH2:19][CH3:20])=[S:26])[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 27582403-(Diethylamino)propyl isothiocyanateHCID 13655034N-(2-phenylsulfonylethyl)-2-propanamine

Product 1

HCID 13655152N'-[3-(Diethylamino)propyl]-N-(1-methylethyl)-N-[2-(phenylsulfonyl)ethyl]thiourea

Sources & evidence

ORD record
ord-39d2ccb7e5c845ff8ab1659da433c257
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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