Acetonitrile → HCID 67205677, compound

HRID 309812Notes

Reaction equation

HRID 309812 reaction equation
[Br:1][CH2:2][CH2:3][c:4]1[cH:5][cH:6][c:7]([O:8][c:9]2[s:10][c:11]3[c:12]([n:13]2)[cH:14][cH:15][cH:16][cH:17]3)[cH:18][cH:19]1.[C:20]([CH3:21])([CH3:22])([CH3:23])[O:24][C:25](=[O:26])[N:27]1[CH:28]2[CH2:29][NH:30][CH:31]([CH2:32]1)[CH2:33]2.[CH3:34][CH2:35][N:36]([CH2:37][CH3:38])[CH2:39][CH3:40].[CH3:41][C:42]#[N:43]>>[CH2:2]([CH2:3][c:4]1[cH:5][cH:6][c:7]([O:8][c:9]2[s:10][c:11]3[c:12]([n:13]2)[cH:14][cH:15][cH:16][cH:17]3)[cH:18][cH:19]1)[N:30]1[CH2:29][CH:28]2[N:27]([C:25]([O:24][C:20]([CH3:21])([CH3:22])[CH3:23])=[O:26])[CH2:32][CH:31]1[CH2:33]2

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 2760898(1S,4S)-tert-butyl 2,5-diazabicyclo(2.2.1)heptane-2-carboxylateHCID 59989179HCID 59989179, compound

Product 1

HCID 67205677HCID 67205677, compound

Sources & evidence

ORD record
ord-9b0ca2517aa5453da8feb5c7b327be60
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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