3,4-Dimethoxybenzene-1-thiol → 6-[4-(3,4-Dimethoxy-phenylmercapto)-butoxy]-4,4-dimethyl-4H-3,1-benzoxazin-2-one

HRID 160816

반응식

HRID 160816 반응식
[CH3:20][O:21][c:22]1[cH:23][c:24]([SH:30])[cH:25][cH:26][c:27]1[O:28][CH3:29].[Cl:1][CH2:2][CH2:3][CH2:4][CH2:5][O:6][c:7]1[cH:8][cH:9][c:10]2[c:11]([cH:19]1)[C:12]([CH3:17])([CH3:18])[O:13][C:14](=[O:16])[NH:15]2>>[CH2:2]([CH2:3][CH2:4][CH2:5][O:6][c:7]1[cH:8][cH:9][c:10]2[c:11]([cH:19]1)[C:12]([CH3:17])([CH3:18])[O:13][C:14](=[O:16])[NH:15]2)[S:30][c:24]1[cH:23][c:22]([O:21][CH3:20])[c:27]([O:28][CH3:29])[cH:26][cH:25]1

참가 물질

3

반응물 2

HCID 1365393,4-Dimethoxybenzene-1-thiolHCID 132605036-(4-Chlorobutoxy)-4,4-dimethyl-1,4-dihydro-2H-3,1-benzoxazin-2-one

생성물 1

HCID 132605206-[4-(3,4-Dimethoxy-phenylmercapto)-butoxy]-4,4-dimethyl-4H-3,1-benzoxazin-2-one

출처 및 근거

ORD 기록
ord-64a9b9905284481e86d587c14afcba66
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

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