Bromide ion → 2-(2-(4-(1-hydroxyethyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide

HRID 1126922

Reaction equation

HRID 1126922 reaction equation
[Br-:28].[CH2:36]1[O:37][CH2:38][CH2:39][CH2:40]1.[CH3:29][Mg+:30].[CH3:31][CH2:32][O:33][CH2:34][CH3:35].[CH:1](=[O:2])[c:3]1[c:4]([C:24]([F:25])([F:26])[F:27])[n:5][n:6]([CH2:8][C:9](=[O:10])[NH:11][c:12]2[c:13]([C:21](=[O:22])[NH2:23])[c:14]3[c:15]([s:16]2)[CH2:17][CH2:18][CH2:19][CH2:20]3)[cH:7]1>>[CH:1]([OH:2])([c:3]1[c:4]([C:24]([F:25])([F:26])[F:27])[n:5][n:6]([CH2:8][C:9](=[O:10])[NH:11][c:12]2[c:13]([C:21](=[O:22])[NH2:23])[c:14]3[c:15]([s:16]2)[CH2:17][CH2:18][CH2:19][CH2:20]3)[cH:7]1)[CH3:31]

Participants

6

Reactant 5

HCID 259Bromide ionHCID 3283Diethyl EtherHCID 8028TetrahydrofuranHCID 595204952-(2-(4-Formyl-3-(trifluoromethyl)pyrazol-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamideHCID 178477777HCID 178477777, compound

Product 1

HCID 236488982-(2-(4-(1-hydroxyethyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide

Sources & evidence

ORD record
ord-5709c388ba3a4bf9b1b5f63388b53b71
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Linked notes

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