Methanol → Ethyl 3-[5'-(3-heptyl-1-methylureido)-2'-methylbiphenyl-4-yl]propanoate

반응식

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

참가 물질

반응물 2

HCID 887Methanol

HCID 77257643Ethyl 3-[4-[5-[heptylcarbamoyl(methyl)amino]-2-methylphenyl]phenyl]prop-2-enoate

생성물 1

HCID 67272247Ethyl 3-[5'-(3-heptyl-1-methylureido)-2'-methylbiphenyl-4-yl]propanoate

출처 및 근거

ORD 기록: ord-7888e09e0c004256b3de42fe6133be27
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

반응 노트

불러오는 중…