Dimethylformamide → 1-[4-(1-Carbomethoxy-1-(3,4-methylenedioxyphenyl)methoxy)-3-chloro-5-propylphenylmethyl]-3-carboethoxy-2-benzimidazolinone

HRID 1150662Notes

Reaction equation

HRID 1150662 reaction equation
[Br:22][CH2:23][c:24]1[cH:25][c:26]([Cl:48])[c:27]([O:28][CH:29]([C:30](=[O:31])[O:32][CH3:33])[c:34]2[cH:35][c:36]3[c:37]([cH:38][cH:39]2)[O:40][CH2:41][O:42]3)[c:43]([CH2:45][CH2:46][CH3:47])[cH:44]1.[C:16](=[O:17])([O-:18])[O-:19].[C:1](=[O:2])([O:3][CH2:4][CH3:5])[n:6]1[c:7](=[O:15])[nH:8][c:9]2[c:10]1[cH:11][cH:12][cH:13][cH:14]2.[Cs+:20].[Cs+:21].[O:49]=[CH:50][N:51]([CH3:52])[CH3:53]>>[C:1](=[O:2])([O:3][CH2:4][CH3:5])[n:6]1[c:7](=[O:15])[n:8]([CH2:23][c:24]2[cH:25][c:26]([Cl:48])[c:27]([O:28][CH:29]([C:30](=[O:31])[O:32][CH3:33])[c:34]3[cH:35][c:36]4[c:37]([cH:38][cH:39]3)[O:40][CH2:41][O:42]4)[c:43]([CH2:45][CH2:46][CH3:47])[cH:44]2)[c:9]2[c:10]1[cH:11][cH:12][cH:13][cH:14]2

Participants

6

Reactant 5

HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 303857Ethyl 2-oxo-2,3-dihydro-1H-benzo[D]imidazole-1-carboxylateHCID 20089193Methyl 2-(4-bromomethyl-2-chloro-6-propylphenoxy)-2-(3,4-methylenedioxyphenyl)acetate

Product 1

HCID 200891971-[4-(1-Carbomethoxy-1-(3,4-methylenedioxyphenyl)methoxy)-3-chloro-5-propylphenylmethyl]-3-carboethoxy-2-benzimidazolinone

Sources & evidence

ORD record
ord-024fd717d6ef4024af6097eb11dbc816
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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