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Sodium Ion → 2-[6-(3,4-Dimethoxyphenyl)-6-[(4-methylphenyl)thio]-hexyl]-1,2,3,4-tetrahydro-6-methoxyisoquinoline

HRID 668512
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HRID 668512 반응식
[Br:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH:7]([S:8][c:9]1[cH:10][cH:11][c:12]([CH3:15])[cH:13][cH:14]1)[c:16]1[cH:17][c:18]([O:24][CH3:25])[c:19]([O:22][CH3:23])[cH:20][cH:21]1.[CH3:26][O:27][c:28]1[cH:29][c:30]2[c:35]([cH:36][cH:37]1)[CH2:34][NH:33][CH2:32][CH2:31]2.[CH3:49][C:50]#[N:51].[CH:38]([N:39]([CH:40]([CH3:41])[CH3:42])[CH2:43][CH3:44])([CH3:45])[CH3:46].[I-:48].[Na+:47]>>[CH2:2]([CH2:3][CH2:4][CH2:5][CH2:6][CH:7]([S:8][c:9]1[cH:10][cH:11][c:12]([CH3:15])[cH:13][cH:14]1)[c:16]1[cH:17][c:18]([O:24][CH3:25])[c:19]([O:22][CH3:23])[cH:20][cH:21]1)[N:33]1[CH2:32][CH2:31][c:30]2[cH:29][c:28]([O:27][CH3:26])[cH:37][cH:36][c:35]2[CH2:34]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 923Sodium IonHCID 6342AcetonitrileHCID 30165Iodide IonHCID 393566-Methoxy-1,2,3,4-tetrahydroisoquinolineHCID 81531DiisopropylethylamineHCID 108122034-[6-Bromo-1-[(4-methylphenyl)thio]hexyl]-1,2-dimethoxybenzene

생성물 1

HCID 10673156
2-[6-(3,4-Dimethoxyphenyl)-6-[(4-methylphenyl)thio]-hexyl]-1,2,3,4-tetrahydro-6-methoxyisoquinoline

출처 및 근거

ORD 기록
ord-c4d4bf2349454ab2aec8ad5aaf1f59be
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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