Sulfuric Acid → rac-(2R,3R,4R,5S)-3-(3-chloro-phenyl)-4-(4-chloro-phenyl)-4-cyano-5-(2,2-dimethyl-propyl)-pyrrolidine-2-carboxylic acid

HRID 1559251Notes

Reaction equation

HRID 1559251 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[CH:8]1[NH:9][CH:10]([CH2:29][C:30]([CH3:31])([CH3:32])[CH3:33])[C:11]([C:20]#[N:21])([c:22]2[cH:23][cH:24][c:25]([Cl:28])[cH:26][cH:27]2)[CH:12]1[c:13]1[cH:14][c:15]([Cl:19])[cH:16][cH:17][cH:18]1.[S:34](=[O:35])(=[O:36])([OH:37])[OH:38]>>[O:5]=[C:6]([OH:7])[CH:8]1[NH:9][CH:10]([CH2:29][C:30]([CH3:31])([CH3:32])[CH3:33])[C:11]([C:20]#[N:21])([c:22]2[cH:23][cH:24][c:25]([Cl:28])[cH:26][cH:27]2)[CH:12]1[c:13]1[cH:14][c:15]([Cl:19])[cH:16][cH:17][cH:18]1

Participants

3

Reactant 2

HCID 1118Sulfuric AcidHCID 66666395rac-(2R,3R,4R,5R)-3-(3-chloro-phenyl)-4-(4-chloro-phenyl)-4-cyano-5-(2,2-dimethyl-propyl)-pyrrolidine-2-carboxylic acid tert-butyl ester

Product 1

HCID 67296837rac-(2R,3R,4R,5S)-3-(3-chloro-phenyl)-4-(4-chloro-phenyl)-4-cyano-5-(2,2-dimethyl-propyl)-pyrrolidine-2-carboxylic acid

Sources & evidence

ORD record
ord-5d521d27bde74e2f8174024f23c3f071
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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