Isopropanol → N-(3-tert-butylphenyl)-4-methyl-1-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide

HRID 202080

反応式

HRID 202080 の反応式
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([NH:11][C:12](=[O:13])[C:14]2([CH3:20])[CH2:15][CH2:16][NH:17][CH2:18][CH2:19]2)[cH:8][cH:9][cH:10]1.[CH:32]([N:33]([CH2:34][CH3:35])[CH:36]([CH3:37])[CH3:38])([CH3:39])[CH3:40].[CH:41]([OH:42])([CH3:43])[CH3:44].[Cl:21][c:22]1[c:23]2[c:24]([n:25][cH:26][n:27]1)[nH:28][cH:29][c:30]2[CH3:31]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([NH:11][C:12](=[O:13])[C:14]2([CH3:20])[CH2:15][CH2:16][N:17]([c:22]3[c:23]4[c:24]([n:25][cH:26][n:27]3)[nH:28][cH:29][c:30]4[CH3:31])[CH2:18][CH2:19]2)[cH:8][cH:9][cH:10]1

参加物

5

出典と根拠

ORDレコード
ord-4f2d88a7aa584d34a61ad841642343a3
出典データセット
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

関連ノート

読み込み中…