Hydrochloric Acid → 6-(5-Benzyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-2-yl)-3-(trifluoromethyl)-[1,2,4]triazolo[3,4-f]pyridazine

HRID 159342

Reaction equation

HRID 159342 reaction equation
[CH2:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[N:9]1[CH2:10][CH:11]2[CH2:12][NH:13][CH2:14][CH:15]2[CH2:16]1.[CH3:40][CH2:41][OH:42].[CH:17]([N:18]([CH:19]([CH3:20])[CH3:21])[CH2:22][CH3:23])([CH3:24])[CH3:25].[Cl:26][c:27]1[n:28][n:29]2[c:30]([cH:31][cH:32]1)[n:33][n:34][c:35]2[C:36]([F:37])([F:38])[F:39].[ClH:1]>>[CH2:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[N:9]1[CH2:10][CH:11]2[CH2:12][N:13]([c:27]3[n:28][n:29]4[c:30]([cH:31][cH:32]3)[n:33][n:34][c:35]4[C:36]([F:37])([F:38])[F:39])[CH2:14][CH:15]2[CH2:16]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 702EthanolHCID 81531DiisopropylethylamineHCID 6136576-Chloro-3-(trifluoromethyl)-(1,2,4)triazolo(4,3-b)pyridazineHCID 44543872-Benzyloctahydropyrrolo[3,4-c]pyrrole

Product 1

HCID 673412436-(5-Benzyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-2-yl)-3-(trifluoromethyl)-[1,2,4]triazolo[3,4-f]pyridazine

Sources & evidence

ORD record
ord-5f8ea61508334eeca2192d2ee7ca1ba2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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