1-(Bromomethyl)-2-(methylsulfanyl)benzene → 4,4-Dimethyl-1-[2-(methylthio)benzyl]-2-(adamantan-2-yl)-1,2-diazetidin-3-one

반응식

[CH3:18][S:19][c:20]1[c:21]([CH2:22][Br:23])[cH:24][cH:25][cH:26][cH:27]1.[CH:1]12[CH:2]([N:11]3[NH:12][C:13]([CH3:16])([CH3:17])[C:14]3=[O:15])[CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2>>[CH:1]12[CH:2]([N:11]3[N:12]([CH2:22][c:21]4[c:20]([S:19][CH3:18])[cH:27][cH:26][cH:25][cH:24]4)[C:13]([CH3:16])([CH3:17])[C:14]3=[O:15])[CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2

참가 물질

반응물 2

HCID 217935191-(Bromomethyl)-2-(methylsulfanyl)benzene

HCID 673028822-(Adamantan-2-yl)-4,4-dimethyl-1,2-diazetidin-3-one

생성물 1

HCID 673027144,4-Dimethyl-1-[2-(methylthio)benzyl]-2-(adamantan-2-yl)-1,2-diazetidin-3-one

출처 및 근거

ORD 기록: ord-4cbfd47eac6d4e1fb3113490172d50d9
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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