3-Chlorobenzo(b)thiophene-2-carbonyl chloride → tert-Butyl (4-{(3-chloro-benzo[b]thiophene-2-carbonyl)-[5-(2,6-dimethyl-pyridin-4-yl)-2-methoxy-benzyl]-amino}-cyclohexyl)-methyl-carbamate

反応式

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

参加物

反応物 2

HCID 5198983-Chlorobenzo(b)thiophene-2-carbonyl chloride

HCID 59683595tert-Butyl {4-[5-(2,6-dimethyl-pyridin-4-yl)-2-methoxy-benzylamino]-cyclohexyl}-methyl-carbamate

生成物 1

HCID 59683479tert-Butyl (4-{(3-chloro-benzo[b]thiophene-2-carbonyl)-[5-(2,6-dimethyl-pyridin-4-yl)-2-methoxy-benzyl]-amino}-cyclohexyl)-methyl-carbamate

出典と根拠

ORDレコード: ord-c4e67e9150db41e59702691b496ec69d
出典データセット: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

反応ノート

読み込み中…