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

HRID 1211056Notes

Reaction equation

HRID 1211056 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:20]([CH2:21][c:22]2[cH:23][cH:24][c:25]([C:28]([F:29])([F:30])[F:31])[cH:26][cH:27]2)[CH3:32])[CH:11]([c:13]2[cH:14][c:15]([Cl:19])[cH:16][cH:17][cH:18]2)[CH2:12]1.[CH3:42][C:43]#[N:44].[Cl:33][C:34]([O:35][CH2:36][C:37]([Cl:38])([Cl:39])[Cl:40])=[O:41]>>[NH:8]1[CH2:9][CH:10]([N:20]([CH2:21][c:22]2[cH:23][cH:24][c:25]([C:28]([F:29])([F:30])[F:31])[cH:26][cH:27]2)[CH3:32])[CH:11]([c:13]2[cH:14][c:15]([Cl:19])[cH:16][cH:17][cH:18]2)[CH2:12]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 870632,2,2-Trichloroethyl chloroformateHCID 67218077[(3RS,4SR)-1-Benzyl-4-(3-chloro-phenyl)-pyrrolidin-3-yl]-methyl-(4-trifluoromethyl-benzyl)-amine

Product 1

HCID 67218391[(3RS,4SR)-4-(3-chloro-phenyl)-pyrrolidin-3-yl]-methyl-(4-trifluoromethyl-benzyl)-amine

Sources & evidence

ORD record
ord-fc763face52042d2b5983bec86597f36
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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