Acetone → 3-[4-Chloro-6-(1,1,3,3-tetramethylbutylamino)-s-triazin-2-yl]-3-azabicyclo[3.2.2]nonane

Reaction equation

[C:22]([CH3:23])([CH3:24])([CH2:25][C:26]([CH3:27])([CH3:28])[CH3:29])[NH2:30].[CH3:18][C:19](=[O:20])[CH3:21].[Cl:1][c:2]1[n:3][c:4]([N:9]2[CH2:10][CH:11]3[CH2:12][CH2:13][CH:14]([CH2:15]2)[CH2:16][CH2:17]3)[n:5][c:6]([Cl:8])[n:7]1.[Na+:32].[OH-:31].[OH2:33]>>[c:2]1([NH:30][C:22]([CH3:23])([CH3:24])[CH2:25][C:26]([CH3:27])([CH3:28])[CH3:29])[n:3][c:4]([N:9]2[CH2:10][CH:11]3[CH2:12][CH2:13][CH:14]([CH2:15]2)[CH2:16][CH2:17]3)[n:5][c:6]([Cl:8])[n:7]1

Participants

Reactant 6

HCID 61017tert-Octylamine

HCID 155725793-(4,6-Dichloro-s-triazin-2-yl)-3-azabicyclo[3.2.2]nonane

Product 1

Sources & evidence

ORD record: ord-756a458f3acd413ab2ae885e7fa76c79
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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