Toluene → 1-[1-(2,4-Dichloropyrimidin-5-yl)ethyl]-1-(4-methoxyphenyl)-3-(1-phenylethyl)urea

反応式

[CH3:20][CH:21]([c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)[N:28]=[C:29]=[O:30].[CH3:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[Cl:1][c:2]1[n:3][cH:4][c:5]([CH:9]([CH3:10])[NH:11][c:12]2[cH:13][cH:14][c:15]([O:18][CH3:19])[cH:16][cH:17]2)[c:6]([Cl:8])[n:7]1>>[Cl:1][c:2]1[n:3][cH:4][c:5]([CH:9]([CH3:10])[N:11]([c:12]2[cH:13][cH:14][c:15]([O:18][CH3:19])[cH:16][cH:17]2)[C:29]([NH:28][CH:21]([CH3:20])[c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)=[O:30])[c:6]([Cl:8])[n:7]1

参加物

反応物 3

HCID 1140Toluene

HCID 85760alpha-Methylbenzyl isocyanate

HCID 10086026(+/-)-[1-(2,4-Dichloro-pyrimidin-5-yl)-ethyl]-(4-methoxy-phenyl)-amine

生成物 1

HCID 219460021-[1-(2,4-Dichloropyrimidin-5-yl)ethyl]-1-(4-methoxyphenyl)-3-(1-phenylethyl)urea

出典と根拠

ORDレコード: ord-4beffc977fdc44ba8fcedc07fef37e58
出典データセット: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

反応ノート

読み込み中…