1-Benzothiophen-2-ylmethylamine → N-(benzo[b]thiophen-2-ylmethyl)-5-(3-(4-fluorobenzyl)-2-oxoimidazolidin-1-yl)-3-methylthiophene-2-carboxamide

HRID 200103Notes

Reaction equation

HRID 200103 reaction equation
[CH3:1][c:2]1[cH:3][c:4]([N:5]2[CH2:6][CH2:7][N:8]([CH2:9][CH2:10][O:11][c:12]3[cH:13][cH:14][cH:15][cH:16][cH:17]3)[C:18]2=[O:19])[s:20][c:21]1[C:22]([OH:23])=[O:24].[F:25][c:26]1[cH:27][cH:28][c:29]([CH2:30][N:31]2[C:32](=[O:45])[N:33]([c:36]3[cH:37][c:38]([CH3:44])[c:39]([C:41](=[O:42])[OH:43])[s:40]3)[CH2:34][CH2:35]2)[cH:46][cH:47]1.[s:48]1[c:49]2[c:50]([cH:51][c:52]1[CH2:53][NH2:54])[cH:55][cH:56][cH:57][cH:58]2>>[F:25][c:26]1[cH:27][cH:28][c:29]([CH2:30][N:31]2[C:32](=[O:45])[N:33]([c:36]3[cH:37][c:38]([CH3:44])[c:39]([C:41](=[O:43])[NH:54][CH2:53][c:52]4[s:48][c:49]5[c:50]([cH:51]4)[cH:55][cH:56][cH:57][cH:58]5)[s:40]3)[CH2:34][CH2:35]2)[cH:46][cH:47]1

Participants

4

Reactant 3

HCID 2370741-Benzothiophen-2-ylmethylamineHCID 580314563-Methyl-5-(2-oxo-3-(2-phenoxyethyl)imidazolidin-1-yl)thiophene-2-carboxylic acidHCID 580314655-(3-(4-Fluorobenzyl)-2-oxoimidazolidin-1-yl)-3-methylthiophene-2-carboxylic acid

Product 1

HCID 59481216N-(benzo[b]thiophen-2-ylmethyl)-5-(3-(4-fluorobenzyl)-2-oxoimidazolidin-1-yl)-3-methylthiophene-2-carboxamide

Sources & evidence

ORD record
ord-72fb7b34404e464eaf19ac40075dcd5f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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