Benzene → Methyl 5-[[2-butyl-5-[3-ethoxy-3-oxo-2-(thiophen-2-ylmethyl)prop-1-enyl]imidazol-1-yl]methyl]thiophene-2-carboxylate

HRID 1564052Notes

Reaction equation

HRID 1564052 reaction equation
[C:22]([OH:23])(=[O:24])[CH:25]([C:26](=[O:27])[O:28][CH2:29][CH3:30])[CH2:31][c:32]1[s:33][cH:34][cH:35][cH:36]1.[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6]([CH2:12][c:13]2[s:14][c:15]([C:18](=[O:19])[O:20][CH3:21])[cH:16][cH:17]2)[c:7]([CH:10]=[O:11])[cH:8][n:9]1.[CH2:37]1[CH2:38][CH2:39][NH:40][CH2:41][CH2:42]1.[cH:43]1[cH:44][cH:45][n:46][cH:47][cH:48]1.[cH:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6]([CH2:12][c:13]2[s:14][c:15]([C:18](=[O:19])[O:20][CH3:21])[cH:16][cH:17]2)[c:7]([CH:10]=[C:25]([C:26](=[O:27])[O:28][CH2:29][CH3:30])[CH2:31][c:32]2[s:33][cH:34][cH:35][cH:36]2)[cH:8][n:9]1

Participants

6

Reactant 5

HCID 241BenzeneHCID 1049PyridineHCID 8082PiperidineHCID 14952883Ethyl 2-carboxy-3-(2-thienyl)propionateHCID 193873192-n-Butyl-1-[(5-carbomethoxy-2-thienyl)methyl]imidazol-5-carboxaldehyde

Product 1

HCID 54075988Methyl 5-[[2-butyl-5-[3-ethoxy-3-oxo-2-(thiophen-2-ylmethyl)prop-1-enyl]imidazol-1-yl]methyl]thiophene-2-carboxylate

Sources & evidence

ORD record
ord-64f4b26231374557991997da934f3c15
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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