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1,4-Dioxane → N-[5-(cyclohexylamino)[1,2,4]triazolo[1,5-a]pyridin-2-yl]-4-{[(2-methoxyethyl)(methyl)amino]methyl}benzamide

HRID 1142465
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HRID 1142465 반응식
[CH3:37][O:38][CH2:39][CH2:40][NH:41][CH3:42].[CH:28]([N:29]([CH2:30][CH3:31])[CH:32]([CH3:33])[CH3:34])([CH3:35])[CH3:36].[Cl:1][CH2:2][c:3]1[cH:4][cH:5][c:6]([C:7](=[O:8])[NH:9][c:10]2[n:11][n:12]3[c:13]([cH:14][cH:15][cH:16][c:17]3[NH:18][CH:19]3[CH2:20][CH2:21][CH2:22][CH2:23][CH2:24]3)[n:25]2)[cH:26][cH:27]1.[O:43]1[CH2:44][CH2:45][O:46][CH2:47][CH2:48]1>>[CH2:2]([c:3]1[cH:4][cH:5][c:6]([C:7](=[O:8])[NH:9][c:10]2[n:11][n:12]3[c:13]([cH:14][cH:15][cH:16][c:17]3[NH:18][CH:19]3[CH2:20][CH2:21][CH2:22][CH2:23][CH2:24]3)[n:25]2)[cH:26][cH:27]1)[N:41]([CH2:40][CH2:39][O:38][CH3:37])[CH3:42]
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참가 물질

5

반응물 4

HCID 312751,4-DioxaneHCID 81531DiisopropylethylamineHCID 300977(2-Methoxyethyl)(methyl)amineHCID 252127664-chloromethyl-N-(5-cyclohexylamino-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-benzamide

생성물 1

HCID 59437471N-[5-(cyclohexylamino)[1,2,4]triazolo[1,5-a]pyridin-2-yl]-4-{[(2-methoxyethyl)(methyl)amino]methyl}benzamide

출처 및 근거

ORD 기록
ord-4b705f3e478046cb828a88bb874838af
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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