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1,2-Dichloroethane → 2-[3-(2,2-Dimethylpropanoyl)-6-methoxy-1H-indazol-1-yl]-N,N-diisobutylacetamide

HRID 302739
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HRID 302739 반응식
[CH2:32]([CH:33]([CH3:34])[CH3:35])[NH:36][CH2:37][CH:38]([CH3:39])[CH3:40].[CH2:55]([Cl:56])[CH2:57][Cl:58].[CH3:1][C:2]([C:3](=[O:4])[c:5]1[n:6][n:7]([CH2:16][C:17](=[O:18])[OH:19])[c:8]2[cH:9][c:10]([O:14][CH3:15])[cH:11][cH:12][c:13]12)([CH3:20])[CH3:21].[CH:41]([N:42]([CH2:43][CH3:44])[CH:45]([CH3:46])[CH3:47])([CH3:48])[CH3:49].[O:50]=[CH:51][N:52]([CH3:53])[CH3:54].[OH:22][n:23]1[c:24]2[c:25]([cH:26][cH:27][cH:28][cH:29]2)[n:30][n:31]1>>[CH3:1][C:2]([C:3](=[O:4])[c:5]1[n:6][n:7]([CH2:16][C:17](=[O:18])[N:36]([CH2:32][CH:33]([CH3:34])[CH3:35])[CH2:37][CH:38]([CH3:39])[CH3:40])[c:8]2[cH:9][c:10]([O:14][CH3:15])[cH:11][cH:12][c:13]12)([CH3:20])[CH3:21]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 111,2-DichloroethaneHCID 6228DimethylformamideHCID 8085DiisobutylamineHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 57675531[3-(2,2-Dimethylpropanoyl)-6-methoxy-1H-indazol-1-yl]acetic acid

생성물 1

HCID 10046629
2-[3-(2,2-Dimethylpropanoyl)-6-methoxy-1H-indazol-1-yl]-N,N-diisobutylacetamide

출처 및 근거

ORD 기록
ord-76536c3e8a25416ba4412d8a9e6610d0
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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