Tetrahydrofuran → (3SR,4RS)-3-(3,4-Dichloro-phenyl)-4-[(3-fluoro-4-trifluoromethyl-benzyl)-methyl-amino]-pyrrolidine-1-carboxylic acid 3-chloro-propyl ester

HRID 180980

Reaction equation

HRID 180980 reaction equation
[CH2:36]([N:37]([CH2:38][CH3:39])[CH2:40][CH3:41])[CH3:42].[CH2:43]1[O:44][CH2:45][CH2:46][CH2:47]1.[Cl:1][C:2](=[O:3])[O:4][CH2:5][CH2:6][CH2:7][Cl:8].[Cl:9][c:10]1[cH:11][c:12]([CH:17]2[CH:18]([N:22]([CH3:23])[CH2:24][c:25]3[cH:26][c:27]([F:35])[c:28]([C:31]([F:32])([F:33])[F:34])[cH:29][cH:30]3)[CH2:19][NH:20][CH2:21]2)[cH:13][cH:14][c:15]1[Cl:16]>>[C:2](=[O:3])([O:4][CH2:5][CH2:6][CH2:7][Cl:8])[N:20]1[CH2:19][CH:18]([N:22]([CH3:23])[CH2:24][c:25]2[cH:26][c:27]([F:35])[c:28]([C:31]([F:32])([F:33])[F:34])[cH:29][cH:30]2)[CH:17]([c:12]2[cH:11][c:10]([Cl:9])[c:15]([Cl:16])[cH:14][cH:13]2)[CH2:21]1

Participants

5

Reactant 4

HCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 69399Carbonochloridic acid, 3-chloropropyl esterHCID 75231672[(3RS,4SR)-4-(3,4-Dichloro-phenyl)-pyrrolidin-3-yl]-(3-fluoro-4-trifluoromethyl-benzyl)-methyl-amine

Product 1

HCID 72253477(3SR,4RS)-3-(3,4-Dichloro-phenyl)-4-[(3-fluoro-4-trifluoromethyl-benzyl)-methyl-amino]-pyrrolidine-1-carboxylic acid 3-chloro-propyl ester

Sources & evidence

ORD record
ord-98d0dabd32c24e1fb0ca8e26b991f070
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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