Methanol → 1-(Ethoxycarbonylaminocarbonyl)-2-(3,5-dimethoxy-4-hydroxyphenyl)-4,5-bis(4-diethylaminophenyl)imidazole

HRID 196620

반응식

HRID 196620 반응식
[CH2:39]([CH3:40])[O:41][C:42](=[O:43])[N:44]=[C:45]=[O:46].[CH3:1][O:2][c:3]1[cH:4][c:5](-[c:12]2[nH:13][c:14](-[c:28]3[cH:29][cH:30][c:31]([N:34]([CH2:35][CH3:36])[CH2:37][CH3:38])[cH:32][cH:33]3)[c:15](-[c:17]3[cH:18][cH:19][c:20]([N:23]([CH2:24][CH3:25])[CH2:26][CH3:27])[cH:21][cH:22]3)[n:16]2)[cH:6][c:7]([O:10][CH3:11])[c:8]1[OH:9].[CH3:47][OH:48].[CH:49]([Cl:50])([Cl:51])[Cl:52]>>[CH3:1][O:2][c:3]1[cH:4][c:5](-[c:12]2[n:13]([C:45]([NH:44][C:42]([O:41][CH2:39][CH3:40])=[O:43])=[O:46])[c:14](-[c:28]3[cH:29][cH:30][c:31]([N:34]([CH2:35][CH3:36])[CH2:37][CH3:38])[cH:32][cH:33]3)[c:15](-[c:17]3[cH:18][cH:19][c:20]([N:23]([CH2:24][CH3:25])[CH2:26][CH3:27])[cH:21][cH:22]3)[n:16]2)[cH:6][c:7]([O:10][CH3:11])[c:8]1[OH:9]

참가 물질

5

출처 및 근거

ORD 기록
ord-aaa199b5762e4876b10a1a66553b9c1a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

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