Potassium Cation → 5-(tert-butoxycarbonylmethoxy)-2-{[N-(5,6-diphenylpyrazin-2-yl)-N-methylamino]methyl}-1,2,3,4-tetrahydronaphthalene

HRID 663474Notes

Reaction equation

HRID 663474 reaction equation
[Br:33][CH2:34][C:35](=[O:36])[O:37][C:38]([CH3:39])([CH3:40])[CH3:41].[C:44](=[O:45])([O-:46])[O-:47].[CH3:50][C:51]#[N:52].[I-:43].[K+:42].[K+:48].[K+:49].[c:1]1(-[c:7]2[n:8][cH:9][c:10]([N:19]([CH3:20])[CH2:21][CH:22]3[CH2:23][c:24]4[cH:25][cH:26][cH:27][c:28]([OH:32])[c:29]4[CH2:30][CH2:31]3)[n:11][c:12]2-[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[n:8][cH:9][c:10]([N:19]([CH3:20])[CH2:21][CH:22]3[CH2:23][c:24]4[cH:25][cH:26][cH:27][c:28]([O:32][CH2:34][C:35](=[O:36])[O:37][C:38]([CH3:39])([CH3:40])[CH3:41])[c:29]4[CH2:30][CH2:31]3)[n:11][c:12]2-[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

7

Reactant 6

HCID 813Potassium Cation3×HCID 6342AcetonitrileHCID 19660Carbonate IonHCID 30165Iodide IonHCID 79177tert-Butyl bromoacetateHCID 184526502-{[N-(5,6-diphenylpyrazin-2-yl)-N-methylamino]methyl}-5-hydroxy-1,2,3,4-tetrahydronaphthalene

Product 1

HCID 184526595-(tert-butoxycarbonylmethoxy)-2-{[N-(5,6-diphenylpyrazin-2-yl)-N-methylamino]methyl}-1,2,3,4-tetrahydronaphthalene

Sources & evidence

ORD record
ord-f1ce0a3dca48453eb71abf80a0153a38
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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