3-Ethynylimidazo[1,2-b]pyridazine → N-(3-(Imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylphenyl)-4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)benzamide

반응식

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

참가 물질

반응물 2

HCID 468387603-Ethynylimidazo[1,2-b]pyridazine

HCID 46838911N-(3-Iodo-4-methylphenyl)-4-((4methylpiperazin-1-yl) methyl)-3-(trifluoromethyl)benzamide

생성물 1

HCID 24826798N-(3-(Imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylphenyl)-4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)benzamide

출처 및 근거

ORD 기록: ord-1f9867502b3c4e14af3c8ef19e0d1612
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

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