2-Butanamine, 3,3-dimethyl- → 2-(4-Chlorophenylsulfonyl)-3-(pyridin-3-ylamino)-3-(1,2,2-trimethylpropylamino)-2-propenenitrile

HRID 203013Notes

Reaction equation

HRID 203013 reaction equation
[CH3:24][CH:25]([C:26]([CH3:27])([CH3:28])[CH3:29])[NH2:30].[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[C:11]([C:12]#[N:13])=[C:14]([NH:15][c:16]2[cH:17][n:18][cH:19][cH:20][cH:21]2)[S:22][CH3:23])[cH:6][cH:7]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[C:11]([C:12]#[N:13])=[C:14]([NH:15][c:16]2[cH:17][n:18][cH:19][cH:20][cH:21]2)[NH:30][CH:25]([CH3:24])[C:26]([CH3:27])([CH3:28])[CH3:29])[cH:6][cH:7]1

Participants

3

Reactant 2

HCID 5209072-Butanamine, 3,3-dimethyl-HCID 701501772-(4-Chlorophenylsulfonyl)-3-methylsulfanyl-3-(pyridin-3-ylamino)-2-propenenitrile

Product 1

HCID 498242302-(4-Chlorophenylsulfonyl)-3-(pyridin-3-ylamino)-3-(1,2,2-trimethylpropylamino)-2-propenenitrile

Sources & evidence

ORD record
ord-a3fa35109a1e4bcb97df415150b10d54
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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