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Sodium Ion → 6-[3-[4-(Diphenylmethoxy)piperidino]propoxy]-2-methyl[1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one

HRID 2316978
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HRID 2316978 반응식
[CH3:40][N:41]([CH3:42])[CH:43]=[O:44].[Cl:27][c:28]1[cH:29][cH:30][c:31]2[n:32]([n:33]1)[c:34](=[O:38])[n:35]([CH3:37])[n:36]2.[H-:25].[Na+:26].[OH2:39].[c:1]1([CH:7]([O:8][CH:9]2[CH2:10][CH2:11][N:12]([CH2:15][CH2:16][CH2:17][OH:18])[CH2:13][CH2:14]2)[c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]([O:8][CH:9]2[CH2:10][CH2:11][N:12]([CH2:15][CH2:16][CH2:17][O:18][c:28]3[cH:29][cH:30][c:31]4[n:32]([n:33]3)[c:34](=[O:38])[n:35]([CH3:37])[n:36]4)[CH2:13][CH2:14]2)[c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1
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HCID 923Sodium IonHCID 962WaterHCID 6228DimethylformamideHCID 166653HydrideHCID 229892644-(Diphenylmethoxy)piperidinepropanolHCID 230003286-chloro-2-methyl[1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one

생성물 1

HCID 23000299
6-[3-[4-(Diphenylmethoxy)piperidino]propoxy]-2-methyl[1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one

출처 및 근거

ORD 기록
ord-16923231b6064a8d9deb160124ae7eba
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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