Sodium ion → 2-[4-amino-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]pyridine-3-carbonitrile

HRID 143856

반응식

HRID 143856 반응식
[CH3:35][N:36]([CH3:37])[CH:38]=[O:39].[Cl:24][c:25]1[c:26]([C:27]#[N:28])[cH:29][cH:30][cH:31][n:32]1.[H-:33].[Na+:34].[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][cH:10][c:11](-[c:14]2[cH:15][nH:16][c:17]3[n:18][cH:19][n:20][c:21]([NH2:23])[c:22]23)[cH:12][cH:13]1>>[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][cH:10][c:11](-[c:14]2[cH:15][n:16](-[c:25]3[c:26]([C:27]#[N:28])[cH:29][cH:30][cH:31][n:32]3)[c:17]3[n:18][cH:19][n:20][c:21]([NH2:23])[c:22]23)[cH:12][cH:13]1

참가 물질

6

출처 및 근거

ORD 기록
ord-67403b082ce54385a572b42b7bfc57f6
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

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