2-Iodotoluene → 2-Methyl-N-[3-(1-{[1-(2-methylphenyl)-1H-indol-5-YL]methyl}-4-piperidinyl)phenyl]propanamide

반응식

[I:1][c:2]1[c:3]([CH3:8])[cH:4][cH:5][cH:6][cH:7]1.[nH:9]1[cH:10][cH:11][c:12]2[cH:13][c:14]([CH2:18][N:19]3[CH2:20][CH2:21][CH:22]([c:25]4[cH:26][c:27]([NH:31][C:32]([CH:33]([CH3:34])[CH3:35])=[O:36])[cH:28][cH:29][cH:30]4)[CH2:23][CH2:24]3)[cH:15][cH:16][c:17]12>>[c:2]1(-[n:9]2[cH:10][cH:11][c:12]3[cH:13][c:14]([CH2:18][N:19]4[CH2:20][CH2:21][CH:22]([c:25]5[cH:26][c:27]([NH:31][C:32]([CH:33]([CH3:34])[CH3:35])=[O:36])[cH:28][cH:29][cH:30]5)[CH2:23][CH2:24]4)[cH:15][cH:16][c:17]23)[c:3]([CH3:8])[cH:4][cH:5][cH:6][cH:7]1

참가 물질

반응물 2

HCID 51282-Iodotoluene

HCID 22049334N-{3-[1-(1H-indol-5-ylmethyl)-4-piperidinyl]phenyl)-2-methylpropanamide

생성물 1

HCID 220493012-Methyl-N-[3-(1-{[1-(2-methylphenyl)-1H-indol-5-YL]methyl}-4-piperidinyl)phenyl]propanamide

출처 및 근거

ORD 기록: ord-00a85112f47641dc91bacaa0891b985f
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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