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2-Methylpentane → N-Cyclohexyl-N-(2,2-dimethoxyethyl)-3-(3-(1-isopropyl-1H-1,2,3-triazol-4-yl)phenethoxy)propanamide

HRID 2147507
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HRID 2147507 반응식
[CH3:23][O:24][CH:25]([CH2:26][NH:27][CH:28]1[CH2:29][CH2:30][CH2:31][CH2:32][CH2:33]1)[O:34][CH3:35].[CH3:36][CH2:37][O:38][C:39](=[O:40])[CH3:41].[CH3:42][CH2:43][CH2:44][CH:45]([CH3:46])[CH3:47].[CH:1]([CH3:2])([CH3:3])[n:4]1[n:5][n:6][c:7](-[c:9]2[cH:10][c:11]([CH2:12][CH2:13][O:14][CH2:15][CH2:16][C:17](=[O:18])[OH:19])[cH:20][cH:21][cH:22]2)[cH:8]1>>[CH:1]([CH3:2])([CH3:3])[n:4]1[n:5][n:6][c:7](-[c:9]2[cH:10][c:11]([CH2:12][CH2:13][O:14][CH2:15][CH2:16][C:17](=[O:19])[N:27]([CH2:26][CH:25]([O:24][CH3:23])[O:34][CH3:35])[CH:28]3[CH2:29][CH2:30][CH2:31][CH2:32][CH2:33]3)[cH:20][cH:21][cH:22]2)[cH:8]1
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반응물 4

HCID 78922-MethylpentaneHCID 8857Ethyl AcetateHCID 3024915N-(2,2-dimethoxyethyl)cyclohexanamineHCID 59290472HCID 59290472, 화합물

생성물 1

HCID 59290386N-Cyclohexyl-N-(2,2-dimethoxyethyl)-3-(3-(1-isopropyl-1H-1,2,3-triazol-4-yl)phenethoxy)propanamide

출처 및 근거

ORD 기록
ord-6fb3d3eee21b410892171527fc3926c3
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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