1,3-Dibromobenzene → 2-(3-Bromophenyl)-4-(4-fluorophenoxy)-5-[4-(methylsulfonyl)phenyl]-3(2H)-pyridazinone

반응식

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

참가 물질

반응물 2

HCID 79271,3-Dibromobenzene

HCID 219341624-(4-fluorophenoxy)-5-[4-(methylsulfonyl)phenyl]-3(2H)-pyridazinone

생성물 1

HCID 101647122-(3-Bromophenyl)-4-(4-fluorophenoxy)-5-[4-(methylsulfonyl)phenyl]-3(2H)-pyridazinone

출처 및 근거

ORD 기록: ord-ec81b1d52b7944e981c718977b5dbe51
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

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