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Sodium Ion → 5-(6-(2-(2,5-Dimethylphenyl)pyrrolidin-1-yl)imidazo[1,2-b]pyridazin-3-yl)-2-fluorobenzonitrile

HRID 154981
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HRID 154981 반응식
[Br:19][c:20]1[cH:21][n:22][c:23]2[n:24]1[n:25][c:26]([N:29]1[CH:30]([c:34]3[c:35]([CH3:41])[cH:36][cH:37][c:38]([CH3:40])[cH:39]3)[CH2:31][CH2:32][CH2:33]1)[cH:27][cH:28]2.[C:7](#[N:8])[c:9]1[cH:10][c:11]([B:16]([OH:17])[OH:18])[cH:12][cH:13][c:14]1[F:15].[Na+:1].[Na+:2].[O-:3][C:4](=[O:5])[O-:6].[O:43]1[CH2:44][CH2:45][O:46][CH2:47][CH2:48]1.[OH2:42]>>[C:7](#[N:8])[c:9]1[cH:10][c:11](-[c:20]2[cH:21][n:22][c:23]3[n:24]2[n:25][c:26]([N:29]2[CH:30]([c:34]4[c:35]([CH3:41])[cH:36][cH:37][c:38]([CH3:40])[cH:39]4)[CH2:31][CH2:32][CH2:33]2)[cH:27][cH:28]3)[cH:12][cH:13][c:14]1[F:15]
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반응물 6

HCID 923Sodium Ion2회HCID 962WaterHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 27579643-Cyano-4-fluorophenylboronic acidHCID 583354743-Bromo-6-(2-(2,5-dimethylphenyl)pyrrolidin-1-yl)imidazo[1,2-b]pyridazine

생성물 1

HCID 44520439
5-(6-(2-(2,5-Dimethylphenyl)pyrrolidin-1-yl)imidazo[1,2-b]pyridazin-3-yl)-2-fluorobenzonitrile

출처 및 근거

ORD 기록
ord-75b2e85cac4343dabed6fd2482213f1d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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