Ammonium → 2-[4-(2,4-Difluoro-phenyl)-4H-[1,2,4]triazol-3-yl]-4,5-dihydro-6-oxa-3-thia-1-aza-benzo[e]azulene-9-carboxylic acid amide

反応式

[Cl-:31].[F:1][c:2]1[c:3](-[n:9]2[c:10](-[c:14]3[s:15][c:16]4[c:22]([n:23]3)-[c:21]3[c:20]([cH:27][cH:26][c:25]([C:28](=[O:29])[OH:30])[cH:24]3)[O:19][CH2:18][CH2:17]4)[n:11][n:12][cH:13]2)[cH:4][cH:5][c:6]([F:8])[cH:7]1.[NH4+:32]>>[F:1][c:2]1[c:3](-[n:9]2[c:10](-[c:14]3[s:15][c:16]4[c:22]([n:23]3)-[c:21]3[c:20]([cH:27][cH:26][c:25]([C:28](=[O:30])[NH2:32])[cH:24]3)[O:19][CH2:18][CH2:17]4)[n:11][n:12][cH:13]2)[cH:4][cH:5][c:6]([F:8])[cH:7]1

参加物

反応物 3

HCID 223Ammonium

HCID 312Chloride

HCID 668686062-[4-(2,4-difluoro-phenyl)-4H-[1,2,4]triazol-3-yl]-4,5-dihydro-6-oxa-3-thia-1-aza-benzo[e]azulene-9-carboxylic acid

生成物 1

HCID 532348942-[4-(2,4-Difluoro-phenyl)-4H-[1,2,4]triazol-3-yl]-4,5-dihydro-6-oxa-3-thia-1-aza-benzo[e]azulene-9-carboxylic acid amide

出典と根拠

ORDレコード: ord-ba33954303c64a67b783acd4bc114072
出典データセット: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

反応ノート

読み込み中…