Potassium Cation → N-{2-[6-Chloro-4-(4-trifluoromethylphenyl)-2H-benzotriazol-2-yl]-1-cyano-1-methylethyl}-4-trifluoromethoxybenzamide

HRID 700622Notes

Reaction equation

HRID 700622 reaction equation
[Br:1][c:2]1[cH:3][c:4]([Cl:30])[cH:5][c:6]2[n:7][n:8]([CH2:11][C:12]([CH3:13])([C:14]#[N:15])[NH:16][C:17]([c:18]3[cH:19][cH:20][c:21]([O:24][C:25]([F:26])([F:27])[F:28])[cH:22][cH:23]3)=[O:29])[n:9][c:10]12.[CH2:46]1[O:47][CH2:48][CH2:49][CH2:50]1.[F-:31].[F:33][C:34]([c:35]1[cH:36][cH:37][c:38]([B:41]([OH:42])[OH:43])[cH:39][cH:40]1)([F:44])[F:45].[K+:32]>>[c:2]1(-[c:38]2[cH:37][cH:36][c:35]([C:34]([F:33])([F:44])[F:45])[cH:40][cH:39]2)[cH:3][c:4]([Cl:30])[cH:5][c:6]2[n:7][n:8]([CH2:11][C:12]([CH3:13])([C:14]#[N:15])[NH:16][C:17]([c:18]3[cH:19][cH:20][c:21]([O:24][C:25]([F:26])([F:27])[F:28])[cH:22][cH:23]3)=[O:29])[n:9][c:10]12

Participants

6

Reactant 5

HCID 813Potassium CationHCID 8028TetrahydrofuranHCID 28179Fluoride IonHCID 27343894-(Trifluoromethyl)phenylboronic acidHCID 66620042HCID 66620042, compound

Product 1

HCID 86625573N-{2-[6-Chloro-4-(4-trifluoromethylphenyl)-2H-benzotriazol-2-yl]-1-cyano-1-methylethyl}-4-trifluoromethoxybenzamide

Sources & evidence

ORD record
ord-0fd36d44ee6841bb95965f2849d1c35a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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