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Sodium Ion → 4'-{[6-ethyl-3-[2-(4-methoxyphenyl)-2-oxoethyl]-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl]methyl}-3'-fluorobiphenyl-2-carbonitrile

HRID 954781
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HRID 954781 반응식
[Br:30][CH2:31][C:32](=[O:33])[c:34]1[cH:35][cH:36][c:37]([O:40][CH3:41])[cH:38][cH:39]1.[CH2:1]([CH3:2])[c:3]1[cH:4][c:5]2[c:6]([n:7]([CH2:13][c:14]3[c:15]([F:28])[cH:16][c:17](-[c:20]4[c:21]([C:26]#[N:27])[cH:22][cH:23][cH:24][cH:25]4)[cH:18][cH:19]3)[c:8](=[O:12])[nH:9][c:10]2=[O:11])[s:29]1.[CH3:42][N:43]([CH3:44])[CH:45]=[O:46].[CH3:49][CH2:50][O:51][C:52](=[O:53])[CH3:54].[H-:47].[Na+:48]>>[CH2:1]([CH3:2])[c:3]1[cH:4][c:5]2[c:6]([n:7]([CH2:13][c:14]3[c:15]([F:28])[cH:16][c:17](-[c:20]4[c:21]([C:26]#[N:27])[cH:22][cH:23][cH:24][cH:25]4)[cH:18][cH:19]3)[c:8](=[O:12])[n:9]([CH2:31][C:32](=[O:33])[c:34]3[cH:35][cH:36][c:37]([O:40][CH3:41])[cH:38][cH:39]3)[c:10]2=[O:11])[s:29]1
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7

반응물 6

HCID 923Sodium IonHCID 4965Bromomethyl 4-methoxyphenyl ketoneHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 166653HydrideHCID 593515684'-[(6-ethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)methyl]-3'-fluorobiphenyl-2-carbonitrile

생성물 1

HCID 59351491
4'-{[6-ethyl-3-[2-(4-methoxyphenyl)-2-oxoethyl]-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl]methyl}-3'-fluorobiphenyl-2-carbonitrile

출처 및 근거

ORD 기록
ord-be7ceba7ab674e8c865c6d67678721fb
출처 데이터셋
Validation data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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