6-(4-Chlorobutoxy)-4,4-dimethyl-1,4-dihydro-2H-3,1-benzoxazin-2-one → 6-[4-(4,6-Dimethyl-2-pyrimidinylmercapto)-butoxy]-4,4-dimethyl-4H-3,1-benzoxazin-2-one

반응식

[CH3:20][c:21]1[n:22][c:23]([SH:28])[n:24][c:25]([CH3:27])[cH:26]1.[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:28][c:23]1[n:22][c:21]([CH3:20])[cH:26][c:25]([CH3:27])[n:24]1

참가 물질

반응물 2

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

HCID 1784266324,6-dimethylpyrimidine-2-thiol

생성물 1

HCID 202816826-[4-(4,6-Dimethyl-2-pyrimidinylmercapto)-butoxy]-4,4-dimethyl-4H-3,1-benzoxazin-2-one

출처 및 근거

ORD 기록: ord-6f6645912b6846c69adb735514d0fa3f
출처 데이터셋: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D

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