Ethyl Acetate → N-[2,6-bis(1-methylethyl)phenyl]-N'-(diphenylmethoxy)-urea

반응식

[CH3:31][CH2:32][O:33][C:34](=[O:35])[CH3:36].[CH:16]([CH3:17])([CH3:18])[c:19]1[c:20]([N:28]=[C:29]=[O:30])[c:21]([CH:25]([CH3:26])[CH3:27])[cH:22][cH:23][cH:24]1.[c:1]1([CH:7]([O:8][NH2:9])[c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]([O:8][NH:9][C:29]([NH:28][c:20]2[c:19]([CH:16]([CH3:17])[CH3:18])[cH:24][cH:23][cH:22][c:21]2[CH:25]([CH3:26])[CH3:27])=[O:30])[c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

참가 물질

반응물 3

HCID 8857Ethyl Acetate

HCID 922592,6-Diisopropylphenyl isocyanate

HCID 198860O-benzhydrylhydroxylamine

생성물 1

HCID 11741848N-[2,6-bis(1-methylethyl)phenyl]-N'-(diphenylmethoxy)-urea

출처 및 근거

ORD 기록: ord-60453ea980484fb3938ab980d72462cf
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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