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Sodium Ion → 1-(4-(5-Amino-6-(5-(4-((methylamino)methyl)phenyl)-1,3,4-oxadiazol-2-yl)pyrazin-2-yl)piperidin-1-yl)propan-1-one

HRID 93551
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인쇄 미리보기

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HRID 93551 반응식
[C:31](=[O:32])([O-:33])[O-:34].[CH3:37][NH2:38].[CH3:44][CH2:45][O:46][C:47](=[O:48])[CH3:49].[NH2:1][c:2]1[n:3][cH:4][c:5]([CH:21]2[CH2:22][CH2:23][N:24]([C:27]([CH2:28][CH3:29])=[O:30])[CH2:25][CH2:26]2)[n:6][c:7]1-[c:8]1[o:9][c:10](-[c:13]2[cH:14][cH:15][c:16]([CH2:19][Br:20])[cH:17][cH:18]2)[n:11][n:12]1.[Na+:35].[Na+:36].[O:39]1[CH2:40][CH2:41][CH2:42][CH2:43]1>>[NH2:1][c:2]1[n:3][cH:4][c:5]([CH:21]2[CH2:22][CH2:23][N:24]([C:27]([CH2:28][CH3:29])=[O:30])[CH2:25][CH2:26]2)[n:6][c:7]1-[c:8]1[o:9][c:10](-[c:13]2[cH:14][cH:15][c:16]([CH2:19][NH:38][CH3:37])[cH:17][cH:18]2)[n:11][n:12]1
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참가 물질

7

반응물 6

HCID 923Sodium Ion2회HCID 6329MethylamineHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 667445751-[4-[5-Amino-6-[5-[4-(bromomethyl)phenyl]-1,3,4-oxadiazol-2-yl]pyrazin-2-yl]-1-piperidyl]propan-1-one

생성물 1

HCID 66745416
1-(4-(5-Amino-6-(5-(4-((methylamino)methyl)phenyl)-1,3,4-oxadiazol-2-yl)pyrazin-2-yl)piperidin-1-yl)propan-1-one

출처 및 근거

ORD 기록
ord-cf0cf1e88f824c42b342622f16d25122
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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