Dichloromethane → 4-(4-Bromophenyl)-5-chloro-2-(2-cyano-acetylamino)-thiophene-3-carboxylic acid ethyl ester

HRID 701867Notes

Reaction equation

HRID 701867 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[c:7]([NH:18][C:19]([CH2:20][C:21]#[N:22])=[O:23])[s:8][cH:9][c:10]1-[c:11]1[cH:12][cH:13][c:14]([Br:17])[cH:15][cH:16]1.[CH2:29]([Cl:30])[Cl:31].[S:24]([Cl:25])(=[O:26])([Cl:27])=[O:28]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[c:7]([NH:18][C:19]([CH2:20][C:21]#[N:22])=[O:23])[s:8][c:9]([Cl:27])[c:10]1-[c:11]1[cH:12][cH:13][c:14]([Br:17])[cH:15][cH:16]1

Participants

4

Reactant 3

HCID 6344DichloromethaneHCID 24648Sulfuryl chlorideHCID 1014753Ethyl 4-(4-bromophenyl)-2-[(cyanoacetyl)amino]thiophene-3-carboxylate

Product 1

HCID 696073704-(4-Bromophenyl)-5-chloro-2-(2-cyano-acetylamino)-thiophene-3-carboxylic acid ethyl ester

Sources & evidence

ORD record
ord-249768a793c343a0ad62a6f0dca3657c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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