Dimethyl Sulfoxide → Ethyl 2-(4,5-difluoro-2-nitroanilino)benzo[b]thiophene-3-carboxylate

HRID 689397Notes

Reaction equation

HRID 689397 reaction equation
[CH3:28][S:29](=[O:30])[CH3:31].[F:16][c:17]1[c:18]([N+:25](=[O:26])[O-:27])[cH:19][c:20]([F:24])[c:21]([F:23])[cH:22]1.[NH2:1][c:2]1[c:3]([C:11](=[O:12])[O:13][CH2:14][CH3:15])[c:4]2[c:5]([s:6]1)[cH:7][cH:8][cH:9][cH:10]2>>[NH:1]([c:2]1[c:3]([C:11](=[O:12])[O:13][CH2:14][CH3:15])[c:4]2[c:5]([s:6]1)[cH:7][cH:8][cH:9][cH:10]2)[c:17]1[c:18]([N+:25](=[O:26])[O-:27])[cH:19][c:20]([F:24])[c:21]([F:23])[cH:22]1

Participants

4

Reactant 3

HCID 679Dimethyl SulfoxideHCID 750121,2,4-Trifluoro-5-nitrobenzeneHCID 699464Ethyl 2-amino-1-benzothiophene-3-carboxylate

Product 1

HCID 18422335Ethyl 2-(4,5-difluoro-2-nitroanilino)benzo[b]thiophene-3-carboxylate

Sources & evidence

ORD record
ord-736a6a8f40324d0ab86aa1ac5d931f59
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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