Sodium ion → Tert-butyl 3-formyl-5-[[1-(4-methoxybutyl)benzimidazole-2-carbonyl]-(2-methylpropyl)amino]piperidine-1-carboxylate

HRID 119926Notes

Reaction equation

HRID 119926 reaction equation
[CH3:45][C:46]#[N:47].[Na+:43].[Na+:44].[OH:1][CH2:2][CH:3]1[CH2:4][N:5]([C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37])[CH2:6][CH:7]([N:9]([CH2:10][CH:11]([CH3:12])[CH3:13])[C:14](=[O:15])[c:16]2[n:17][c:18]3[c:19]([n:20]2[CH2:21][CH2:22][CH2:23][CH2:24][O:25][CH3:26])[cH:27][cH:28][cH:29][cH:30]3)[CH2:8]1.[S:38]([O-:39])([O-:40])(=[O:41])=[S:42]>>[O:1]=[CH:2][CH:3]1[CH2:4][N:5]([C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37])[CH2:6][CH:7]([N:9]([CH2:10][CH:11]([CH3:12])[CH3:13])[C:14](=[O:15])[c:16]2[n:17][c:18]3[c:19]([n:20]2[CH2:21][CH2:22][CH2:23][CH2:24][O:25][CH3:26])[cH:27][cH:28][cH:29][cH:30]3)[CH2:8]1

Participants

5

Reactant 4

HCID 923Sodium ion2×HCID 1084Thiosulfate ionHCID 6342AcetonitrileHCID 76731650Tert-butyl 3-(hydroxymethyl)-5-[[1-(4-methoxybutyl)benzimidazole-2-carbonyl]-(2-methylpropyl)amino]piperidine-1-carboxylate

Product 1

HCID 76731630Tert-butyl 3-formyl-5-[[1-(4-methoxybutyl)benzimidazole-2-carbonyl]-(2-methylpropyl)amino]piperidine-1-carboxylate

Sources & evidence

ORD record
ord-1858f1fb010d4646b2c8540137a7afba
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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