p-Fluorophenethylamine → 6-[4-(5-Fluoro-2-trifluoromethylbenzoyl)piperazin-1-YL]imidazo[1,2-B]pyridazine-2-carboxylic acid [2-(4-fluoro-phenyl)ethyl]amide

反応式

[CH2:11]([O:13][C:14](=[O:12])[c:16]1[n:17][c:18]2[n:19]([n:20][c:21]([N:24]3[CH2:25][CH2:26][N:27]([C:30]([c:31]4[c:32]([C:38]([F:39])([F:40])[F:41])[cH:33][cH:34][c:35]([F:37])[cH:36]4)=[O:42])[CH2:28][CH2:29]3)[cH:22][cH:23]2)[cH:43]1)[CH3:15].[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][CH2:9][NH2:10])[cH:6][cH:7]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][CH2:9][NH:10][C:14](=[O:13])[c:16]2[n:17][c:18]3[n:19]([n:20][c:21]([N:24]4[CH2:25][CH2:26][N:27]([C:30]([c:31]5[c:32]([C:38]([F:39])([F:40])[F:41])[cH:33][cH:34][c:35]([F:37])[cH:36]5)=[O:42])[CH2:28][CH2:29]4)[cH:22][cH:23]3)[cH:43]2)[cH:6][cH:7]1

参加物

反応物 2

HCID 4653p-Fluorophenethylamine

HCID 668634596-[4-(5-Fluoro-2-trifluoromethylbenzoyl)piperazin-1-YL]imidazo[1,2-B]pyridazine-2-carboxylic acid ethyl ester

生成物 1

HCID 114977386-[4-(5-Fluoro-2-trifluoromethylbenzoyl)piperazin-1-YL]imidazo[1,2-B]pyridazine-2-carboxylic acid [2-(4-fluoro-phenyl)ethyl]amide

出典と根拠

ORDレコード: ord-8db8f419eaa9446b93a6d9e460452993
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…