Ethanol → 5-amino-1-cyclohexanesulfonyl-3-(1-methyl-1,2,3,6-tetrahydropyridine-4-yl)-1H-indole

반응식

[CH3:29][CH2:30][OH:31].[CH:1]1([S:7](=[O:8])(=[O:9])[n:10]2[cH:11][c:12]([C:22]3=[CH:27][CH2:26][N:25]([CH3:28])[CH2:24][CH2:23]3)[c:13]3[cH:14][c:15]([N+:19]([O-:20])=[O:21])[cH:16][cH:17][c:18]23)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1>>[CH:1]1([S:7](=[O:8])(=[O:9])[n:10]2[cH:11][c:12]([C:22]3=[CH:27][CH2:26][N:25]([CH3:28])[CH2:24][CH2:23]3)[c:13]3[cH:14][c:15]([NH2:19])[cH:16][cH:17][c:18]23)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

참가 물질

반응물 2

HCID 702Ethanol

HCID 115242241-cyclohexanesulfonyl-3-(1-methyl-1,2,3,6-tetrahydropyridine-4-yl) 5-nitro-1H-indole

생성물 1

HCID 112225605-amino-1-cyclohexanesulfonyl-3-(1-methyl-1,2,3,6-tetrahydropyridine-4-yl)-1H-indole

출처 및 근거

ORD 기록: ord-c908ee823938457a82554726a0a4aba6
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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