1,2-Dichloroethane → [2-(3'-Chloro-2,3,5,6-tetrahydro-[1,2']bipyrazinyl-4-yl)-ethyl]-methyl-carbamic acid t-butyl ester

HRID 116636Notes

Reaction equation

HRID 116636 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([N:7]([CH2:8][CH:9]=[O:10])[CH3:11])=[O:12].[C:26]([O:27][BH-:28]([O:29][C:30](=[O:31])[CH3:32])[O:33][C:34](=[O:35])[CH3:36])(=[O:37])[CH3:38].[Cl:13][c:14]1[c:15]([N:20]2[CH2:21][CH2:22][NH:23][CH2:24][CH2:25]2)[n:16][cH:17][cH:18][n:19]1.[Cl:40][CH2:41][CH2:42][Cl:43].[Na+:39]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([N:7]([CH2:8][CH2:9][N:23]1[CH2:22][CH2:21][N:20]([c:15]2[c:14]([Cl:13])[n:19][cH:18][cH:17][n:16]2)[CH2:25][CH2:24]1)[CH3:11])=[O:12]

Participants

6

Reactant 5

HCID 111,2-DichloroethaneHCID 923Sodium ionHCID 2724942TriacetoxyborohydrideHCID 10725881tert-butyl N-methyl-N-(2-oxoethyl)carbamateHCID 140864382-Chloro-3-(piperazin-1-yl)pyrazine

Product 1

HCID 59252215[2-(3'-Chloro-2,3,5,6-tetrahydro-[1,2']bipyrazinyl-4-yl)-ethyl]-methyl-carbamic acid t-butyl ester

Sources & evidence

ORD record
ord-53e1c0b573594d2a959154f946f84f64
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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