Benzene → 6-phenyl-8-chloro-4H-s-triazolo[4,3-a][1,4]benzodiazepine-1-carboxaldehyde

HRID 151687

반응식

[GeH4:24].[c:1]1([C:7]2=[N:8][CH2:9][c:10]3[n:11]([c:19]([CH2:22][OH:23])[n:20][n:21]3)-[c:12]3[c:13]2[cH:14][c:15]([Cl:18])[cH:16][cH:17]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[cH:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[c:1]1([C:7]2=[N:8][CH2:9][c:10]3[n:11]([c:19]([CH:22]=[O:23])[n:20][n:21]3)-[c:12]3[c:13]2[cH:14][c:15]([Cl:18])[cH:16][cH:17]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1

참가 물질

반응물 3

HCID 241Benzene

HCID 23984Germanium tetrahydride

HCID 162244alpha-Hydroxyalprazolam

생성물 1

HCID 214860116-phenyl-8-chloro-4H-s-triazolo[4,3-a][1,4]benzodiazepine-1-carboxaldehyde

출처 및 근거

ORD 기록: ord-5a2eca15c4b742aaa7ef59a3a17c995a
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

연결된 노트

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