2,6-Diisopropylphenyl isocyanate → N'-(2,6-diisopropylphenyl)-N-(4-isopropylphenyl)-N-[(2-methoxy-5-pyridyl)methyl]urea

반응식

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

참가 물질

반응물 2

HCID 922592,6-Diisopropylphenyl isocyanate

HCID 21957879(4-Isopropylphenyl)[(2-methoxy-5-pyridyl)methyl]amine

생성물 1

HCID 21957908N'-(2,6-diisopropylphenyl)-N-(4-isopropylphenyl)-N-[(2-methoxy-5-pyridyl)methyl]urea

출처 및 근거

ORD 기록: ord-465e4be1fad5474a9a05b1635b47d7c3
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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