Tetrahydrofuran → 3-(3,5-Dichlorophenyl)-1-(7-methoxyquinolin-3-yl)prop-2-yn-1-one

반응식

[CH2:29]1[O:30][CH2:31][CH2:32][CH2:33]1.[CH3:11][O:12][N:13]([C:14](=[O:15])[c:16]1[cH:17][n:18][c:19]2[cH:20][c:21]([O:26][CH3:27])[cH:22][cH:23][c:24]2[cH:25]1)[CH3:28].[Cl:1][c:2]1[cH:3][c:4]([Cl:10])[cH:5][c:6]([C:8]#[CH:9])[cH:7]1>>[Cl:1][c:2]1[cH:3][c:4]([Cl:10])[cH:5][c:6]([C:8]#[C:9][C:14](=[O:15])[c:16]2[cH:17][n:18][c:19]3[cH:20][c:21]([O:26][CH3:27])[cH:22][cH:23][c:24]3[cH:25]2)[cH:7]1

참가 물질

반응물 3

HCID 8028Tetrahydrofuran

HCID 138235471,3-Dichloro-5-ethynylbenzene

HCID 86094167HCID 86094167, 화합물

생성물 1

HCID 674869013-(3,5-Dichlorophenyl)-1-(7-methoxyquinolin-3-yl)prop-2-yn-1-one

출처 및 근거

ORD 기록: ord-7b908dd7147842d89c6fb16bbe2c116c
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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