Ethyl 3-(4-amino-1H-indazol-1-yl)benzoate → Ethyl 3-(4-{[4-(2,3-dihydro-1-benzofuran-7-yl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]amino}-1h-indazol-1-yl)benzoate

HRID 1556864

반응식

HRID 1556864 반응식
[CH3:1][C:2]([CH2:3][C:4]1([C:7]([F:8])([F:9])[F:10])[O:5][CH2:6]1)([CH3:11])[c:12]1[cH:13][cH:14][cH:15][c:16]2[c:20]1[O:19][CH2:18][CH2:17]2.[NH2:21][c:22]1[c:23]2[cH:24][n:25][n:26](-[c:31]3[cH:32][c:33]([C:34](=[O:35])[O:36][CH2:37][CH3:38])[cH:39][cH:40][cH:41]3)[c:27]2[cH:28][cH:29][cH:30]1>>[CH3:1][C:2]([CH2:3][C:4]([OH:5])([CH2:6][NH:21][c:22]1[c:23]2[cH:24][n:25][n:26](-[c:31]3[cH:32][c:33]([C:34](=[O:35])[O:36][CH2:37][CH3:38])[cH:39][cH:40][cH:41]3)[c:27]2[cH:28][cH:29][cH:30]1)[C:7]([F:8])([F:9])[F:10])([CH3:11])[c:12]1[cH:13][cH:14][cH:15][c:16]2[c:20]1[O:19][CH2:18][CH2:17]2

참가 물질

3

반응물 2

HCID 57615935Ethyl 3-(4-amino-1H-indazol-1-yl)benzoateHCID 577755187-[1,1-Dimethyl-2-(2-trifluoromethyloxiranyl)ethyl]-2,3-dihydrobenzofuran

생성물 1

HCID 57615954Ethyl 3-(4-{[4-(2,3-dihydro-1-benzofuran-7-yl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]amino}-1h-indazol-1-yl)benzoate

출처 및 근거

ORD 기록
ord-c9259e4b7f6948858baebe7c5ba1305d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

연결된 노트

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