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Sodium Ion → 4-{4-(4-Fluorophenyl)-1-[1-(isoxazol-3-ylmethyl)piperidin-4-yl]-1H-imidazol-5-yl}-N-methylpyrimidin-2-amine

HRID 120848
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HRID 120848 반응식
[C:1]([O:2][BH-:3]([O:4][C:5](=[O:6])[CH3:7])[O:8][C:9](=[O:10])[CH3:11])(=[O:12])[CH3:13].[CH2:53]1[O:54][CH2:55][CH2:56][CH2:57]1.[CH3:48][CH2:49][O:50][CH2:51][CH3:52].[F:15][c:16]1[cH:17][cH:18][c:19](-[c:22]2[n:23][cH:24][n:25]([CH:35]3[CH2:36][CH2:37][NH:38][CH2:39][CH2:40]3)[c:26]2-[c:27]2[n:28][c:29]([NH:33][CH3:34])[n:30][cH:31][cH:32]2)[cH:20][cH:21]1.[Na+:14].[o:41]1[n:42][c:43]([CH:46]=[O:47])[cH:44][cH:45]1>>[F:15][c:16]1[cH:17][cH:18][c:19](-[c:22]2[n:23][cH:24][n:25]([CH:35]3[CH2:36][CH2:37][N:38]([CH2:46][c:43]4[n:42][o:41][cH:45][cH:44]4)[CH2:39][CH2:40]3)[c:26]2-[c:27]2[n:28][c:29]([NH:33][CH3:34])[n:30][cH:31][cH:32]2)[cH:20][cH:21]1
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반응물 6

HCID 923Sodium IonHCID 3283Diethyl EtherHCID 8028TetrahydrofuranHCID 2724942TriacetoxyborohydrideHCID 99284384-[4-(4-fluorophenyl)-1-piperidin-4-yl-1H-imidazol-5-yl]-N-methylpyrimidin-2-amineHCID 183730781,2-Oxazole-3-carbaldehyde

생성물 1

HCID 58235138
4-{4-(4-Fluorophenyl)-1-[1-(isoxazol-3-ylmethyl)piperidin-4-yl]-1H-imidazol-5-yl}-N-methylpyrimidin-2-amine

출처 및 근거

ORD 기록
ord-c02fc06e7fa441f9a141afcb1f5fb071
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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