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Potassium Cation → 5,7-Dimethyl-2-(3-nitrophenyl)-4-(3,4,5-trimethoxyphenoxy)imidazo[5,1-f][1,2,4]triazine

HRID 125851
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HRID 125851 반응식
[CH3:1][C:2]([CH3:3])([O-:4])[CH3:5].[CH3:20][c:21]1[n:22][c:23]([CH3:44])[n:24]2[n:25][c:26](-[c:35]3[cH:36][c:37]([N+:41](=[O:42])[O-:43])[cH:38][cH:39][cH:40]3)[n:27][c:28](-[n:30]3[cH:31][n:32][cH:33][n:34]3)[c:29]12.[CH3:7][O:8][c:9]1[cH:10][c:11]([OH:12])[cH:13][c:14]([O:15][CH3:16])[c:17]1[O:18][CH3:19].[K+:6].[O:45]1[CH2:46][CH2:47][CH2:48][CH2:49]1>>[CH3:7][O:8][c:9]1[cH:10][c:11]([O:12][c:28]2[n:27][c:26](-[c:35]3[cH:36][c:37]([N+:41](=[O:42])[O-:43])[cH:38][cH:39][cH:40]3)[n:25][n:24]3[c:23]([CH3:44])[n:22][c:21]([CH3:20])[c:29]32)[cH:13][c:14]([O:15][CH3:16])[c:17]1[O:18][CH3:19]
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반응물 5

HCID 813Potassium CationHCID 8028TetrahydrofuranHCID 695053,4,5-TrimethoxyphenolHCID 45749132-Methylpropan-2-olateHCID 184491105,7-Dimethyl-2-(3-nitrophenyl)-4-(1H-1,2,4-triazol-1-yl)imidazo[5,1-f][1,2,4]triazine

생성물 1

HCID 184491115,7-Dimethyl-2-(3-nitrophenyl)-4-(3,4,5-trimethoxyphenoxy)imidazo[5,1-f][1,2,4]triazine

출처 및 근거

ORD 기록
ord-7e3b013dd72d4d4faffcb832b8a2bf44
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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