Sodium ion → 5-[4-[[7-(2-Fluoro-4-methylsulfonylphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl]oxy]piperidin-1-yl]-3-propan-2-yl-1,2,4-oxadiazole

HRID 693800

반응식

HRID 693800 반응식
[CH2:39]1[O:40][CH2:41][CH2:42][CH2:43]1.[CH3:22][CH:23]([CH3:24])[c:25]1[n:26][o:27][c:28]([N:30]2[CH2:31][CH2:32][CH:33]([OH:36])[CH2:34][CH2:35]2)[n:29]1.[Cl:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[N:8]([c:11]1[c:12]([F:21])[cH:13][c:14]([S:17](=[O:18])(=[O:19])[CH3:20])[cH:15][cH:16]1)[CH2:9][CH2:10]2.[H-:38].[Na+:37]>>[c:2]1([O:36][CH:33]2[CH2:32][CH2:31][N:30]([c:28]3[o:27][n:26][c:25]([CH:23]([CH3:22])[CH3:24])[n:29]3)[CH2:35][CH2:34]2)[c:3]2[c:4]([n:5][cH:6][n:7]1)[N:8]([c:11]1[c:12]([F:21])[cH:13][c:14]([S:17](=[O:18])(=[O:19])[CH3:20])[cH:15][cH:16]1)[CH2:9][CH2:10]2

참가 물질

6

반응물 5

HCID 923Sodium ionHCID 8028TetrahydrofuranHCID 166653HydrideHCID 218977441-(3-Isopropyl-1,2,4-oxadiazol-5-YL)piperidin-4-OLHCID 426368224-Chloro-7-(2-fluoro-4-(methylsulfonyl)phenyl)-6,7-dihydro-5H-pyrrolo[2,3-D]pyrimidine

생성물 1

HCID 580170325-[4-[[7-(2-Fluoro-4-methylsulfonylphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl]oxy]piperidin-1-yl]-3-propan-2-yl-1,2,4-oxadiazole

출처 및 근거

ORD 기록
ord-ced48dc8b5834e61b53291bd426dc41d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

연결된 노트

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