Hydrochloric Acid → N-(2-Acetyl-4,4-dimethyl-1,2,3,4-tetrahydroisoquinolin-7-yl)-2-[(1H-pyrrolo[2,3-b]pyridin-6-ylmethyl)amino]nicotinamide
反応式
[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][c:6]2[cH:7][c:8]([NH:16][C:17]([c:18]3[c:19]([F:24])[n:20][cH:21][cH:22][cH:23]3)=[O:25])[cH:9][cH:10][c:11]2[C:12]([CH3:14])([CH3:15])[CH2:13]1.[ClH:26].[ClH:27].[nH:28]1[cH:29][cH:30][c:31]2[c:32]1[n:33][c:34]([CH2:37][NH2:38])[cH:35][cH:36]2>>[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][c:6]2[cH:7][c:8]([NH:16][C:17]([c:18]3[c:19]([NH:38][CH2:37][c:34]4[n:33][c:32]5[nH:28][cH:29][cH:30][c:31]5[cH:36][cH:35]4)[n:20][cH:21][cH:22][cH:23]3)=[O:25])[cH:9][cH:10][c:11]2[C:12]([CH3:14])([CH3:15])[CH2:13]1参加物
4
反応物 3
生成物 1
出典と根拠
- ORDレコード
- ord-116ed9af988f4c168191a1e22f161e9c
- 出典データセット
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)