3,4-Difluorobenzaldehyde → HCID 59560083, 화합물

HRID 672366

반응식

HRID 672366 반응식
[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([O:7][c:8]2[cH:9][cH:10][c:11]([S:12]([CH3:13])(=[O:14])=[O:15])[cH:16][cH:17]2)[cH:18][c:19]2[c:24]1[CH2:23][CH:21]([CH3:22])[O:20]2)=[O:25].[CH3:36][n:37]1[n:38][c:39]([NH:42][C:43](=[O:44])[c:45]2[cH:46][c:47]3[c:48]([c:54]([OH:56])[cH:55]2)[CH2:49][C:50]([CH3:52])([CH3:53])[O:51]3)[cH:40][cH:41]1.[F:26][c:27]1[cH:28][c:29]([CH:30]=[O:31])[cH:32][cH:33][c:34]1[F:35]>>[F:26][c:27]1[cH:28][c:29]([CH:30]=[O:31])[cH:32][cH:33][c:34]1[O:56][c:54]1[c:48]2[c:47]([cH:46][c:45]([C:43]([NH:42][c:39]3[n:38][n:37]([CH3:36])[cH:41][cH:40]3)=[O:44])[cH:55]1)[O:51][C:50]([CH3:52])([CH3:53])[CH2:49]2

참가 물질

4

반응물 3

HCID 5880883,4-DifluorobenzaldehydeHCID 595600842,3-Dihydro-4-hydroxy-2,2-dimethyl-N-(1-methyl-1H-pyrazol-3-yl)-6-benzofurancarboxamideHCID 595604376-(4-Methanesulfonyl-phenoxy)-2-methyl-2,3-dihydro-benzofuran-4-carboxylic acid methyl ester

생성물 1

HCID 59560083HCID 59560083, 화합물

출처 및 근거

ORD 기록
ord-a8d11035791146589d1389aad9f7196c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

연결된 노트

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