1-Methyl-3-aminopyrazole → 1-(1-methyl-1H-pyrazole-3-yl)-4-(2,2,4,6,7-pentamethyl-2,3-dihydro-1-benzofuran-5-yl)piperazine

HRID 668149Notes

Reaction equation

HRID 668149 reaction equation
[CH3:22][n:23]1[n:24][c:25]([NH2:28])[cH:26][cH:27]1.[Cl:1][CH2:2][CH2:3][N:4]([c:5]1[c:6]([CH3:18])[c:7]([CH3:17])[c:8]2[c:9]([c:15]1[CH3:16])[CH2:10][C:11]([CH3:13])([CH3:14])[O:12]2)[CH2:19][CH2:20][Cl:21]>>[CH2:2]1[CH2:3][N:4]([c:5]2[c:6]([CH3:18])[c:7]([CH3:17])[c:8]3[c:9]([c:15]2[CH3:16])[CH2:10][C:11]([CH3:13])([CH3:14])[O:12]3)[CH2:19][CH2:20][N:28]1[c:25]1[n:24][n:23]([CH3:22])[cH:27][cH:26]1

Participants

3

Reactant 2

HCID 1372541-Methyl-3-aminopyrazoleHCID 66760837N,N-bis(2-chloroethyl)-2,2,4,6,7-pentamethyl-2,3-dihydro-1-benzofuran-5-amine

Product 1

HCID 594850241-(1-methyl-1H-pyrazole-3-yl)-4-(2,2,4,6,7-pentamethyl-2,3-dihydro-1-benzofuran-5-yl)piperazine

Sources & evidence

ORD record
ord-a3349a2970f848eb901232edd77d1766
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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