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Acetate → 4-Methoxy-3-(2-pyridin-3-ylethenyl)-1-tritylindazole-5-carbonitrile

HRID 100325
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HRID 100325 반응식
[Br:35][c:36]1[cH:37][n:38][cH:39][cH:40][cH:41]1.[C:67]([O-:68])(=[O:69])[CH3:70].[C:72]([O-:73])(=[O:74])[CH3:75].[CH3:64][C:65]#[N:66].[CH:1](=[CH2:2])[c:3]1[n:4][n:5]([C:16]([c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)([c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[c:6]2[cH:7][cH:8][c:9]([C:14]#[N:15])[c:10]([O:12][CH3:13])[c:11]12.[Pd+2:71].[c:42]1([CH3:43])[cH:44][cH:45][c:46]([P:47]([c:48]2[cH:49][cH:50][c:51]([CH3:52])[cH:53][cH:54]2)[c:55]2[cH:56][cH:57][c:58]([CH3:59])[cH:60][cH:61]2)[cH:62][cH:63]1>>[CH:1](=[CH:2][c:36]1[cH:37][n:38][cH:39][cH:40][cH:41]1)[c:3]1[n:4][n:5]([C:16]([c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)([c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[c:6]2[cH:7][cH:8][c:9]([C:14]#[N:15])[c:10]([O:12][CH3:13])[c:11]12
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 175Acetate2회HCID 6342AcetonitrileHCID 122863-BromopyridineHCID 13956Phosphine, tris(4-methylphenyl)-HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 230701273-vinyl-4-methoxy-1-trityl-1H-indazole-5-carbonitrile

생성물 1

HCID 68928545
4-Methoxy-3-(2-pyridin-3-ylethenyl)-1-tritylindazole-5-carbonitrile

출처 및 근거

ORD 기록
ord-55b93586ec34476f9648e175bcf59e45
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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