Water → N-[[4-(4-ethylthiophen-2-yl)oxyphenyl]methyl]-2,4-dimethyl-1,3-oxazole-5-carboxamide

HRID 144370

반응식

HRID 144370 반응식
[CH2:11]1[CH2:12][CH2:13][CH:14]([N:15]=[C:16]=[N:17][CH:18]2[CH2:19][CH2:20][CH2:21][CH2:22][CH2:23]2)[CH2:24][CH2:25]1.[CH2:26]([CH3:27])[c:28]1[cH:29][c:30]([O:33][c:34]2[cH:35][cH:36][c:37]([CH2:38][NH2:39])[cH:40][cH:41]2)[s:31][cH:32]1.[CH3:1][c:2]1[o:3][c:4]([C:8](=[O:9])[OH:10])[c:5]([CH3:7])[n:6]1.[Cl:43][CH2:44][Cl:45].[OH2:42]>>[CH3:1][c:2]1[o:3][c:4]([C:8](=[O:10])[NH:39][CH2:38][c:37]2[cH:36][cH:35][c:34]([O:33][c:30]3[cH:29][c:28]([CH2:26][CH3:27])[cH:32][s:31]3)[cH:41][cH:40]2)[c:5]([CH3:7])[n:6]1

참가 물질

6

출처 및 근거

ORD 기록
ord-972832f98d9b4e399bf70e8e7c6737cc
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

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