7-Benzyl-4-hydroxy-3-methyl-6-oxo-6,7-dihydro-thieno[2,3-b]pyridine-5-carboxylic acid ethyl ester → 7-Benzyl-4-chloro-6,7-dihydro-3-methyl-6-oxo-thieno[2,3-b]pyridine-5-carbonitrile

HRID 2314497

반응식

HRID 2314497 반응식
[CH2:1]([O:2][C:3]([c:4]1[c:5](=[O:6])[n:7]([CH2:8][c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[c:15]2[s:16][cH:17][c:18]([CH3:19])[c:20]2[c:21]1[OH:22])=[O:23])[CH3:24].[CH2:25]([c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1)[n:32]1[c:33]2[c:34]([c:35]([Cl:41])[c:36]([C:39]#[N:40])[c:37]1=[O:38])[cH:42][cH:43][s:44]2>>[CH3:1][c:42]1[c:34]2[c:33]([n:32]([CH2:25][c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[c:37](=[O:38])[c:36]([C:39]#[N:40])[c:35]2[Cl:41])[s:44][cH:43]1

참가 물질

3

출처 및 근거

ORD 기록
ord-e2c15947f9134e95992196dd8963bdab
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

연결된 노트

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