Cyanide → tert-Butyl [7-cyano-1-(3,4-dichlorobenzyl)-1,2,3,4-tetrahydronaphthalen-2-yl]carbamate

HRID 2346640Notes

Reaction equation

HRID 2346640 reaction equation
[C-:44]#[N:45].[C-:47]#[N:48].[CH3:36][N:37]([CH3:38])[CH:39]=[O:40].[Cl:41][CH2:42][Cl:43].[F:1][C:2]([F:3])([F:4])[S:5]([O:6][c:7]1[cH:8][c:9]2[c:14]([cH:15][cH:16]1)[CH2:13][CH2:12][CH:11]([NH:17][C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH:10]2[CH2:25][c:26]1[cH:27][c:28]([Cl:33])[c:29]([Cl:32])[cH:30][cH:31]1)(=[O:34])=[O:35].[Zn+2:46]>>[c:7]1([C:36]#[N:37])[cH:8][c:9]2[c:14]([cH:15][cH:16]1)[CH2:13][CH2:12][CH:11]([NH:17][C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH:10]2[CH2:25][c:26]1[cH:27][c:28]([Cl:33])[c:29]([Cl:32])[cH:30][cH:31]1

Participants

6

Reactant 5

HCID 5975Cyanide2×HCID 6228DimethylformamideHCID 6344DichloromethaneHCID 32051Zinc(2+)HCID 574672097-[(tert-Butoxycarbonyl)amino]-8-(3,4-dichlorobenzyl)-5,6,7,8-tetrahydronaphthalen-2-yl trifluoromethanesulfonate

Product 1

HCID 57467208tert-Butyl [7-cyano-1-(3,4-dichlorobenzyl)-1,2,3,4-tetrahydronaphthalen-2-yl]carbamate

Sources & evidence

ORD record
ord-15b053a7676741e6969891d532535a30
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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