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N,N-Dimethyl-1,3-propanediamine → 2-Ethyl-8-isopropyl-5-morpholino-8H-pyrazolo[4',3':5,6]pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidine

HRID 1232264
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HRID 1232264 반응식
[CH2:18]([n:19]1[c:20]2[n:21][cH:22][c:23]([C:24]([OH:25])=[O:26])[c:27]([NH:28][NH2:29])[c:30]2[cH:31][n:32]1)[CH3:33].[CH2:34]1[CH2:35][O:36][CH2:37][CH2:38][NH:39]1.[CH3:40][N:41]([CH3:42])[CH2:43][CH2:44][CH2:45][NH2:46].[CH:1]([n:2]1[c:3]2[n:4][cH:5][c:6]([C:7]([OH:8])=[O:9])[c:10]([NH:11][NH2:12])[c:13]2[cH:14][n:15]1)([CH3:16])[CH3:17].[Cl:47][c:48]1[n:49][c:50]2[n:51]([c:52]3[c:53]1[cH:54][n:55][c:56]1[c:57]3[cH:58][n:59][n:60]1[CH:61]([CH3:62])[CH3:63])[n:64][c:65]([CH2:67][CH3:68])[n:66]2>>[CH2:34]1[CH2:35][O:36][CH2:37][CH2:38][N:39]1[c:48]1[n:49][c:50]2[n:51]([c:52]3[c:53]1[cH:54][n:55][c:56]1[c:57]3[cH:58][n:59][n:60]1[CH:61]([CH3:62])[CH3:63])[n:64][c:65]([CH2:67][CH3:68])[n:66]2
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반응물 5

HCID 7993N,N-Dimethyl-1,3-propanediamineHCID 8083MorpholineHCID 227585085-chloro-2-ethyl-8-isopropyl-8H-pyrazolo[4',3':5,6]pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidineHCID 234596211-Ethyl-4-hydrazinylpyrazolo[3,4-b]pyridine-5-carboxylic acidHCID 234596364-Hydrazinyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylic acid

생성물 1

HCID 22758539
2-Ethyl-8-isopropyl-5-morpholino-8H-pyrazolo[4',3':5,6]pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidine

출처 및 근거

ORD 기록
ord-1be839e7817e44b79413c3ecd9d44e3c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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