3,5-Dimethoxybenzoic Acid → 3,5-dimethoxy-N-[[3-[2-methyl-5-(3-methylphenyl)-1,3-thiazole-4-carbonyl]-3-azabicyclo[3.1.0]hexan-2-yl]methyl]benzamide

반응식

[CH3:24][O:25][c:26]1[cH:27][c:28]([C:29](=[O:30])[OH:31])[cH:32][c:33]([O:35][CH3:36])[cH:34]1.[NH2:1][CH2:2][CH:3]1[CH:4]2[CH2:5][CH:6]2[CH2:7][N:8]1[C:9](=[O:10])[c:11]1[n:12][c:13]([CH3:23])[s:14][c:15]1-[c:16]1[cH:17][c:18]([CH3:22])[cH:19][cH:20][cH:21]1>>[NH:1]([CH2:2][CH:3]1[CH:4]2[CH2:5][CH:6]2[CH2:7][N:8]1[C:9](=[O:10])[c:11]1[n:12][c:13]([CH3:23])[s:14][c:15]1-[c:16]1[cH:17][c:18]([CH3:22])[cH:19][cH:20][cH:21]1)[C:29]([c:28]1[cH:27][c:26]([O:25][CH3:24])[cH:34][c:33]([O:35][CH3:36])[cH:32]1)=[O:30]

참가 물질

반응물 2

HCID 143323,5-Dimethoxybenzoic Acid

HCID 68444173[2-(Aminomethyl)-3-azabicyclo[3.1.0]hexan-3-yl]-[2-methyl-5-(3-methylphenyl)-1,3-thiazol-4-yl]methanone

생성물 1

HCID 684456323,5-dimethoxy-N-[[3-[2-methyl-5-(3-methylphenyl)-1,3-thiazole-4-carbonyl]-3-azabicyclo[3.1.0]hexan-2-yl]methyl]benzamide

출처 및 근거

ORD 기록: ord-e570eb5bfe2b4a4a9314b89f58a58ac6
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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