2-Butanamine, 3,3-dimethyl- → 3-(4-Chlorophenylamino)-2-methylsulfonyl-3-(1,2,2-trimethylpropylamino)-propenenitrile

반응식

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

참가 물질

반응물 2

HCID 5209072-Butanamine, 3,3-dimethyl-

HCID 701491873-(4-Chlorophenylamino)-2-methylsulfonyl-3-methylsulfanyl-propenenitrile

생성물 1

HCID 701491893-(4-Chlorophenylamino)-2-methylsulfonyl-3-(1,2,2-trimethylpropylamino)-propenenitrile

출처 및 근거

ORD 기록: ord-a7e82a7dd2d544b3bc251e71e92935a7
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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