1-[2-(4-Iodophenoxy)ethyl]-4-methylpiperidin-4-ol → 1-(2-{4-[5-(2,4-Dichlorophenyl)pyrazin-2-ylethynyl]phenoxy}ethyl)-4-methylpiperidin-4-ol

反応式

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

参加物

反応物 2

HCID 578453271-[2-(4-Iodophenoxy)ethyl]-4-methylpiperidin-4-ol

HCID 860769732-(2,4-Dichlorophenyl)-5-ethynylpyrazine

生成物 1

HCID 578453131-(2-{4-[5-(2,4-Dichlorophenyl)pyrazin-2-ylethynyl]phenoxy}ethyl)-4-methylpiperidin-4-ol

出典と根拠

ORDレコード: ord-460752ba5149487381eae8a5afcf92dc
出典データセット: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

反応ノート

読み込み中…