Indole → 3-[3-(4-benzyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-5-(1,2,4-triazol-4-yl)-1H-indole

반응식

[CH2:19]([c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)[C:26]1=[CH:27][CH2:28][NH:29][CH2:30][CH2:31]1.[n:1]1[n:2][cH:3][n:4](-[c:6]2[cH:7][c:8]3[c:9]([CH2:15][CH2:16][CH2:17][OH:18])[cH:10][nH:11][c:12]3[cH:13][cH:14]2)[cH:5]1.[nH:32]1[c:33]2[c:34]([cH:35][cH:36][cH:37][cH:38]2)[cH:39][cH:40]1>>[n:1]1[n:2][cH:3][n:4](-[c:6]2[cH:7][c:8]3[c:9]([CH2:15][CH2:16][CH2:17][N:29]4[CH2:28][CH:27]=[C:26]([CH2:19][c:20]5[cH:21][cH:22][cH:23][cH:24][cH:25]5)[CH2:31][CH2:30]4)[cH:10][nH:11][c:12]3[cH:13][cH:14]2)[cH:5]1

참가 물질

반응물 3

HCID 798Indole

HCID 106339143-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]propan-1-ol

HCID 136327214-Benzyl-1,2,5,6-tetrahydropyridine

생성물 1

HCID 189753563-[3-(4-benzyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-5-(1,2,4-triazol-4-yl)-1H-indole

출처 및 근거

ORD 기록: ord-257528b417b041979e64f592b18d5344
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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