2-Oxazolidinone → 3-{4-[4-(2-Ethyl-4-methylphenyl)piperazine-1-carbonyl]-3-methanesulfonylphenyl}oxazolidin-2-one

반응식

[Br:1][c:2]1[cH:3][c:4]([S:25](=[O:26])(=[O:27])[CH3:28])[c:5]([C:8](=[O:9])[N:10]2[CH2:11][CH2:12][N:13]([c:16]3[c:17]([CH2:23][CH3:24])[cH:18][c:19]([CH3:22])[cH:20][cH:21]3)[CH2:14][CH2:15]2)[cH:6][cH:7]1.[O:29]1[C:30](=[O:34])[NH:31][CH2:32][CH2:33]1>>[c:2]1([N:31]2[C:30](=[O:34])[O:29][CH2:33][CH2:32]2)[cH:3][c:4]([S:25](=[O:26])(=[O:27])[CH3:28])[c:5]([C:8](=[O:9])[N:10]2[CH2:11][CH2:12][N:13]([c:16]3[c:17]([CH2:23][CH3:24])[cH:18][c:19]([CH3:22])[cH:20][cH:21]3)[CH2:14][CH2:15]2)[cH:6][cH:7]1

참가 물질

반응물 2

HCID 739492-Oxazolidinone

HCID 58484563(4-Bromo-2-methanesulfonylphenyl)[4-(2-ethyl-4-methylphenyl)piperazin-1-yl]methanone

생성물 1

HCID 673809753-{4-[4-(2-Ethyl-4-methylphenyl)piperazine-1-carbonyl]-3-methanesulfonylphenyl}oxazolidin-2-one

출처 및 근거

ORD 기록: ord-a89e0b7eb1e34ab89a2ab27e72f0b869
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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