Potassium Cation → tert-Butyl 5-{3-[(4-cyanophenyl)amino]propyl}hexahydropyrrolo[3,4-c]pyrrole-2(1H)-carboxylate

HRID 90502

Reaction equation

HRID 90502 reaction equation
[CH2:24]1[N:25]([C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[CH2:26][CH:27]2[CH:28]1[CH2:29][NH:30][CH2:31]2.[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:6]([O:7][CH2:12][CH2:13][CH2:14][NH:15][c:16]2[cH:17][cH:18][c:19]([C:22]#[N:23])[cH:20][cH:21]2)(=[O:8])=[O:9])[cH:10][cH:11]1.[CH3:45][C:46]#[N:47].[K+:39].[K+:40].[O-:41][C:42]([O-:43])=[O:44]>>[CH2:12]([CH2:13][CH2:14][NH:15][c:16]1[cH:17][cH:18][c:19]([C:22]#[N:23])[cH:20][cH:21]1)[N:30]1[CH2:29][CH:28]2[CH2:24][N:25]([C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[CH2:26][CH:27]2[CH2:31]1

Participants

6

Reactant 5

HCID 813Potassium Cation2×HCID 6342AcetonitrileHCID 19660Carbonate IonHCID 4142526Tert-butyl octahydropyrrolo(3,4-c)pyrrole-2-carboxylateHCID 218676523-(4-Cyanoanilino)propyl 4-methylbenzenesulfonate

Product 1

HCID 21867558tert-Butyl 5-{3-[(4-cyanophenyl)amino]propyl}hexahydropyrrolo[3,4-c]pyrrole-2(1H)-carboxylate

Sources & evidence

ORD record
ord-47834959ace64a128ab76409b2e4c337
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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