4-(2,4-Dimethylphenyl)piperazin-1-ylethylamine → 1-t-Butyl-5-(4-chlorophenyl)-3-{2-[4-(2,4-dimethylphenyl)piperazin-1-yl]-ethyl}aminomethylpyrazole

HRID 2152793Notes

Reaction equation

HRID 2152793 reaction equation
[CH3:1][c:2]1[c:3]([N:9]2[CH2:10][CH2:11][N:12]([CH2:15][CH2:16][NH2:17])[CH2:13][CH2:14]2)[cH:4][cH:5][c:6]([CH3:8])[cH:7]1.[Cl:18][c:19]1[cH:20][cH:21][c:22](-[c:25]2[cH:26][c:27]([CH:34]=[O:35])[n:28][n:29]2[C:30]([CH3:31])([CH3:32])[CH3:33])[cH:23][cH:24]1>>[CH3:1][c:2]1[c:3]([N:9]2[CH2:10][CH2:11][N:12]([CH2:15][CH2:16][NH:17][CH2:34][c:27]3[cH:26][c:25](-[c:22]4[cH:21][cH:20][c:19]([Cl:18])[cH:24][cH:23]4)[n:29]([C:30]([CH3:31])([CH3:32])[CH3:33])[n:28]3)[CH2:13][CH2:14]2)[cH:4][cH:5][c:6]([CH3:8])[cH:7]1

Participants

3

Reactant 2

HCID 47424664-(2,4-Dimethylphenyl)piperazin-1-ylethylamineHCID 866110605-(4-Chlorophenyl)-1-t-butylpyrazole-3-carbaldehyde

Product 1

HCID 160385641-t-Butyl-5-(4-chlorophenyl)-3-{2-[4-(2,4-dimethylphenyl)piperazin-1-yl]-ethyl}aminomethylpyrazole

Sources & evidence

ORD record
ord-3ddca77dac57454badc572538dfdf19b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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