Acetonitrile → 6-{(SR)-1-[(3RS,4SR)-4-(3,4-Dichloro-phenyl)-pyrrolidin-3-yl]-ethoxy}-nicotinonitrile

反応式

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH:10]([CH:21]([CH3:22])[O:23][c:24]2[n:25][cH:26][c:27]([C:28]#[N:29])[cH:30][cH:31]2)[CH:11]([c:13]2[cH:14][c:15]([Cl:20])[c:16]([Cl:19])[cH:17][cH:18]2)[CH2:12]1.[CH3:41][C:42]#[N:43].[Cl:32][C:33]([O:34][CH2:35][C:36]([Cl:37])([Cl:38])[Cl:39])=[O:40]>>[NH:8]1[CH2:9][CH:10]([CH:21]([CH3:22])[O:23][c:24]2[n:25][cH:26][c:27]([C:28]#[N:29])[cH:30][cH:31]2)[CH:11]([c:13]2[cH:14][c:15]([Cl:20])[c:16]([Cl:19])[cH:17][cH:18]2)[CH2:12]1

参加物

反応物 3

HCID 6342Acetonitrile

HCID 870632,2,2-Trichloroethyl chloroformate

HCID 669994036-{(SR)-1-[(3RS,4SR)-1-Benzyl-4-(3,4-dichloro-phenyl)-pyrrolidin-3-yl]-ethoxy}-nicotinonitrile

生成物 1

HCID 669997186-{(SR)-1-[(3RS,4SR)-4-(3,4-Dichloro-phenyl)-pyrrolidin-3-yl]-ethoxy}-nicotinonitrile

出典と根拠

ORDレコード: ord-63c21f3be3294fd7a26b07e9410583f0
出典データセット: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

反応ノート

読み込み中…