Water → Tert-butyl 3-[(4-chlorobenzoyl)amino]-4-(3,4-dichlorophenyl)pyrrolidine-1-carboxylate

HRID 137562Notes

Reaction equation

HRID 137562 reaction equation
[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[CH3:51][C:52]#[N:53].[Cl:40][C:41](=[O:42])[c:43]1[cH:44][cH:45][c:46]([Cl:47])[cH:48][cH:49]1.[NH2:12][CH:13]1[CH2:14][N:15]([C:26](=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32])[CH2:16][CH:17]1[c:18]1[cH:19][c:20]([Cl:25])[c:21]([Cl:24])[cH:22][cH:23]1.[OH2:50].[c:1]1([CH3:2])[cH:3][cH:4][c:5]([S:6]([OH:7])(=[O:8])=[O:9])[cH:10][cH:11]1>>[NH:12]([CH:13]1[CH2:14][N:15]([C:26](=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32])[CH2:16][CH:17]1[c:18]1[cH:19][c:20]([Cl:25])[c:21]([Cl:24])[cH:22][cH:23]1)[C:41](=[O:42])[c:43]1[cH:44][cH:45][c:46]([Cl:47])[cH:48][cH:49]1

Participants

7

Reactant 6

HCID 962WaterHCID 6101p-Toluenesulfonic acidHCID 6342AcetonitrileHCID 8471TriethylamineHCID 85014-Chlorobenzoyl chlorideHCID 68302939HCID 68302939, compound

Product 1

HCID 70999254Tert-butyl 3-[(4-chlorobenzoyl)amino]-4-(3,4-dichlorophenyl)pyrrolidine-1-carboxylate

Sources & evidence

ORD record
ord-12ed4ec8fc0544c9892ee660409123aa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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