Tetrahydrofuran → N-(bicyclo[2.2.1]heptan-2-ylmethyl)-2-mercapto-nicotinamide

HRID 691275Notes

Reaction equation

HRID 691275 reaction equation
[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[CH:1]12[CH:2]([CH2:8][NH2:9])[CH2:3][CH:4]([CH2:5][CH2:6]1)[CH2:7]2.[P-:10]([F:11])([F:12])([F:13])([F:14])([F:15])[F:16].[SH:34][c:35]1[c:36]([C:37](=[O:38])[OH:39])[cH:40][cH:41][cH:42][n:43]1.[n:17]1([O:18][C:19]([N:20]([CH3:21])[CH3:22])=[N+:23]([CH3:24])[CH3:25])[c:26]2[n:27][cH:28][cH:29][cH:30][c:31]2[n:32][n:33]1>>[CH:1]12[CH:2]([CH2:8][NH:9][C:37]([c:36]3[c:35]([SH:34])[n:43][cH:42][cH:41][cH:40]3)=[O:38])[CH2:3][CH:4]([CH2:5][CH2:6]1)[CH2:7]2

Participants

6

Reactant 5

HCID 8028TetrahydrofuranHCID 9886HexafluorophosphateHCID 97761Bicyclo(2.2.1)heptane-2-methanamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 178524460HCID 178524460, compound

Product 1

HCID 178522760N-(bicyclo[2.2.1]heptan-2-ylmethyl)-2-mercapto-nicotinamide

Sources & evidence

ORD record
ord-6d776cf037fc4505b6ce842a530e3a0c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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