Chloride → N-[1-(3,5-dichloro-1-benzothiophen-2-yl)propan-2-yl]-3-(difluoromethyl)-N-methoxy-1-methylpyrazole-4-carboxamide

HRID 160269Notes

Reaction equation

HRID 160269 reaction equation
[CH2:38]([Cl:39])[Cl:40].[CH3:18][CH2:19][N:20]([CH2:21][CH3:22])[CH2:23][CH3:24].[Cl-:25].[Cl:1][c:2]1[c:3]2[c:4]([s:5][c:6]1[CH2:7][CH:8]([CH3:9])[NH:10][O:11][CH3:12])[cH:13][cH:14][c:15]([Cl:17])[cH:16]2.[F:26][CH:27]([c:28]1[n:29][n:30]([CH3:36])[cH:31][c:32]1[C:33](=[O:34])[OH:35])[F:37]>>[Cl:1][c:2]1[c:3]2[c:4]([s:5][c:6]1[CH2:7][CH:8]([CH3:9])[N:10]([O:11][CH3:12])[C:33]([c:32]1[c:28]([CH:27]([F:26])[F:37])[n:29][n:30]([CH3:36])[cH:31]1)=[O:34])[cH:13][cH:14][c:15]([Cl:17])[cH:16]2

Participants

6

Reactant 5

HCID 312ChlorideHCID 6344DichloromethaneHCID 8471TriethylamineHCID 189830083-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acidHCID 871899521-(3,5-dichloro-1-benzothiophen-2-yl)-N-methoxypropan-2-amine

Product 1

HCID 49837956N-[1-(3,5-dichloro-1-benzothiophen-2-yl)propan-2-yl]-3-(difluoromethyl)-N-methoxy-1-methylpyrazole-4-carboxamide

Sources & evidence

ORD record
ord-21c1eacc64794862a9efac1641cc53cd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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