2-Methyl-5-m-tolyl-thiazole-4-carboxylic acid → 2,2,2-trifluoro-N-[[3-[2-methyl-5-(3-methylphenyl)-1,3-thiazole-4-carbonyl]-3-azabicyclo[3.1.0]hexan-2-yl]methyl]acetamide

반응식

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

참가 물질

반응물 2

HCID 532718162-Methyl-5-m-tolyl-thiazole-4-carboxylic acid

HCID 76542722N-(3-azabicyclo[3.1.0]hexan-2-ylmethyl)-2,2,2-trifluoroacetamide

생성물 1

HCID 765427242,2,2-trifluoro-N-[[3-[2-methyl-5-(3-methylphenyl)-1,3-thiazole-4-carbonyl]-3-azabicyclo[3.1.0]hexan-2-yl]methyl]acetamide

출처 및 근거

ORD 기록: ord-87b4eb919e0e4a388db2cb7f054014a0
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

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