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Formic Acid → 4-{5,7-Dimethyl-4-[(3,4,5-trimethoxyphenyl)amino]imidazo[5,1-f][1,2,4]triazin-2-yl}phenylformamide

HRID 2153032
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HRID 2153032 반응식
[C:16]([Cl:17])(=[O:18])[C:19]([Cl:20])=[O:21].[CH3:6][CH2:7][N:8]([CH2:9][CH3:10])[CH2:11][CH3:12].[CH:13](=[O:14])[OH:15].[Cl:53][CH2:54][Cl:55].[NH2:22][c:23]1[cH:24][cH:25][c:26](-[c:29]2[n:30][n:31]3[c:32]([c:33]([NH:35][c:36]4[cH:37][c:38]([O:46][CH3:47])[c:39]([O:44][CH3:45])[c:40]([O:42][CH3:43])[cH:41]4)[n:34]2)[c:48]([CH3:52])[n:49][c:50]3[CH3:51])[cH:27][cH:28]1.[nH:1]1[cH:2][cH:3][n:4][cH:5]1>>[CH:13](=[O:15])[NH:22][c:23]1[cH:24][cH:25][c:26](-[c:29]2[n:30][n:31]3[c:32]([c:33]([NH:35][c:36]4[cH:37][c:38]([O:46][CH3:47])[c:39]([O:44][CH3:45])[c:40]([O:42][CH3:43])[cH:41]4)[n:34]2)[c:48]([CH3:52])[n:49][c:50]3[CH3:51])[cH:27][cH:28]1
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반응물 6

HCID 284Formic AcidHCID 795ImidazoleHCID 6344DichloromethaneHCID 8471TriethylamineHCID 65578Oxalyl chlorideHCID 11742877N-[2-(4-Aminophenyl)-5,7-dimethylimidazo[5,1-f][1,2,4]triazin-4-yl]-N-(3,4,5-trimethoxyphenyl)amine

생성물 1

HCID 58677756
4-{5,7-Dimethyl-4-[(3,4,5-trimethoxyphenyl)amino]imidazo[5,1-f][1,2,4]triazin-2-yl}phenylformamide

출처 및 근거

ORD 기록
ord-3bc9c18b3941430893139252ef5af745
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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