1-(3-(Trifluoromethyl)phenyl)piperazine → (RS)-1-(3-Methoxy-benzenesulfonyl)-3-phenyl-4-[4-(3-trifluoromethyl-phenyl)-piperazine-1-carbonyl]-imidazolidin-2-one

反応式

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

参加物

反応物 2

HCID 42961-(3-(Trifluoromethyl)phenyl)piperazine

HCID 67141122(RS)-1-(3-methoxy-benzenesulfonyl)-2-oxo-3-phenyl-imidazolidine-4-carboxylic acid

生成物 1

HCID 25027710(RS)-1-(3-Methoxy-benzenesulfonyl)-3-phenyl-4-[4-(3-trifluoromethyl-phenyl)-piperazine-1-carbonyl]-imidazolidin-2-one

出典と根拠

ORDレコード: ord-1d6d2897b09c4b9bb520f6f0024f99ba
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…