2-(4-Methylphenyl)benzoic acid → HCID 178423714, 화합물

반응식

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

참가 물질

반응물 2

HCID 815682-(4-Methylphenyl)benzoic acid

HCID 1784324426-methyl-N-[(5-methyl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-3-yl)methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide

생성물 1

HCID 178423714HCID 178423714, 화합물

출처 및 근거

ORD 기록: ord-4b141d4fbae14f589b8257edea8417ce
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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