Acetonitrile → [(3RS,4SR)-4-(3,4-Dichloro-phenyl)pyrrolidin-3-yl]-methyl-(4-trifluoromethyl-benzyl)-amine

HRID 1137429Notes

Reaction equation

HRID 1137429 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH:10]([N:21]([CH2:22][c:23]2[cH:24][cH:25][c:26]([C:29]([F:30])([F:31])[F:32])[cH:27][cH:28]2)[CH3:33])[CH:11]([c:13]2[cH:14][c:15]([Cl:20])[c:16]([Cl:19])[cH:17][cH:18]2)[CH2:12]1.[CH3:43][C:44]#[N:45].[Cl:34][C:35]([O:36][CH2:37][C:38]([Cl:39])([Cl:40])[Cl:41])=[O:42]>>[NH:8]1[CH2:9][CH:10]([N:21]([CH2:22][c:23]2[cH:24][cH:25][c:26]([C:29]([F:30])([F:31])[F:32])[cH:27][cH:28]2)[CH3:33])[CH:11]([c:13]2[cH:14][c:15]([Cl:20])[c:16]([Cl:19])[cH:17][cH:18]2)[CH2:12]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 870632,2,2-Trichloroethyl chloroformateHCID 67218013[(3RS,4SR)-1-Benzyl-4-(3,4-dichloro-phenyl)-pyrrolidin-3-yl]-methyl-(4-trifluoromethyl-benzyl)-amine

Product 1

HCID 67217816[(3RS,4SR)-4-(3,4-Dichloro-phenyl)pyrrolidin-3-yl]-methyl-(4-trifluoromethyl-benzyl)-amine

Sources & evidence

ORD record
ord-7219f557cb644aa19e76d41ba44e0289
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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