Hexafluorophosphate → 4-amino-N-(1-ethylpiperidin-4-yl)-3-fluorobenzamide

HRID 2143087

反応式

HRID 2143087 の反応式
[CH:45]([N:46]([CH2:47][CH3:48])[CH:49]([CH3:50])[CH3:51])([CH3:52])[CH3:53].[NH2:12][CH:13]1[CH2:14][CH2:15][N:16]([CH2:19][CH3:20])[CH2:17][CH2:18]1.[NH2:1][c:2]1[c:3]([F:11])[cH:4][c:5]([C:6](=[O:7])[OH:8])[cH:9][cH:10]1.[P-:21]([F:22])([F:23])([F:24])([F:25])([F:26])[F:27].[n:28]1([O:29][C:30]([N:31]([CH3:32])[CH3:33])=[N+:34]([CH3:35])[CH3:36])[c:37]2[n:38][cH:39][cH:40][cH:41][c:42]2[n:43][n:44]1>>[NH2:1][c:2]1[c:3]([F:11])[cH:4][c:5]([C:6](=[O:8])[NH:12][CH:13]2[CH2:14][CH2:15][N:16]([CH2:19][CH3:20])[CH2:17][CH2:18]2)[cH:9][cH:10]1

参加物

6

反応物 5

HCID 9886HexafluorophosphateHCID 99714-Amino-3-fluorobenzoic acidHCID 81531DiisopropylethylamineHCID 37349901-Ethylpiperidin-4-amineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminium

生成物 1

HCID 551027824-amino-N-(1-ethylpiperidin-4-yl)-3-fluorobenzamide

出典と根拠

ORDレコード
ord-bf6172339f284dba960d481ce4a79c5d
出典データセット
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

関連ノート

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