Chloride → 2-(4-tert-butyl-3-chlorophenoxy)-N-[1-[4-(methanesulfonamido)phenyl]ethyl]acetamide

HRID 2322738ノート

反応式

HRID 2322738 の反応式
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([Cl:16])[cH:7][c:8]([O:9][CH2:10][C:11](=[O:12])[OH:13])[cH:14][cH:15]1.[CH3:41][CH2:42][N:43]([CH2:44][CH3:45])[CH2:46][CH3:47].[Cl-:17].[Cl:18][CH:19]1[N:20]([CH3:21])[CH2:22][CH2:23][NH+:24]1[CH3:25].[ClH:26].[NH2:27][CH:28]([CH3:29])[c:30]1[cH:31][cH:32][c:33]([NH:36][S:37](=[O:38])(=[O:39])[CH3:40])[cH:34][cH:35]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([Cl:16])[cH:7][c:8]([O:9][CH2:10][C:11](=[O:13])[NH:27][CH:28]([CH3:29])[c:30]2[cH:31][cH:32][c:33]([NH:36][S:37](=[O:38])(=[O:39])[CH3:40])[cH:34][cH:35]2)[cH:14][cH:15]1

参加物

7

反応物 6

HCID 312ChlorideHCID 313Hydrochloric AcidHCID 8471TriethylamineHCID 16785149N-(4-(1-aminoethyl)phenyl)methanesulfonamideHCID 21097497(4-tert-Butyl-3-chlorophenoxy)acetic acidHCID 575014672-Chloro-1,3-dimethylimidazolidin-1-ium

生成物 1

HCID 210974382-(4-tert-butyl-3-chlorophenoxy)-N-[1-[4-(methanesulfonamido)phenyl]ethyl]acetamide

出典と根拠

ORDレコード
ord-8f96221addc142a7a55ed21405bec1de
出典データセット
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反応ノート

読み込み中…