Hydrogen Peroxide → 8-[4-(4-Acetamido-phenylsulfinyl)-butoxy]-4,4-dimethyl-4H-3,1-benzoxazin-2-one

반응식

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

참가 물질

반응물 2

HCID 784Hydrogen Peroxide

HCID 202817098-[4-(4-Acetamido-phenylmercapto)-butoxy]-4,4-dimethyl-4H-3,1-benzoxazin-2-one

생성물 1

HCID 202817898-[4-(4-Acetamido-phenylsulfinyl)-butoxy]-4,4-dimethyl-4H-3,1-benzoxazin-2-one

출처 및 근거

ORD 기록: ord-82cca13614ac433da1e87acfac60e3e8
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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