N-(2,2-dimethoxyethyl)cyclopentanamine → N-Cyclopentyl-N-(2,2-dimethoxyethyl)-3-(3-(1-ethyl-1H-pyrazol-4-yl)phenethoxy)propanamide

반응식

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

참가 물질

반응물 2

HCID 58168622N-(2,2-dimethoxyethyl)cyclopentanamine

HCID 592904833-(3-(1-ethyl-1H-pyrazol-4-yl)phenethoxy)propanoic acid

생성물 1

HCID 59290486N-Cyclopentyl-N-(2,2-dimethoxyethyl)-3-(3-(1-ethyl-1H-pyrazol-4-yl)phenethoxy)propanamide

출처 및 근거

ORD 기록: ord-351726c38a974524b7c393cad97f9166
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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