2-Methyl-1-naphthalenecarboxylic acid → 5-(3,4-Dimethoxyphenyl)-4,4-dimethyl-2-{1-[(2-methylnaphthalen-1-yl)carbonyl]piperidin-4-yl}-2,4-dihydro-3H-pyrazol-3-one
반응식
[CH3:1][O:2][c:3]1[cH:4][c:5]([C:11]2=[N:15][N:14]([CH:16]3[CH2:17][CH2:18][NH:19][CH2:20][CH2:21]3)[C:13](=[O:22])[C:12]2([CH3:23])[CH3:24])[cH:6][cH:7][c:8]1[O:9][CH3:10].[CH3:25][c:26]1[c:27]([C:36](=[O:37])[OH:38])[c:28]2[cH:29][cH:30][cH:31][cH:32][c:33]2[cH:34][cH:35]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]([C:11]2=[N:15][N:14]([CH:16]3[CH2:17][CH2:18][N:19]([C:36]([c:27]4[c:26]([CH3:25])[cH:35][cH:34][c:33]5[c:28]4[cH:29][cH:30][cH:31][cH:32]5)=[O:37])[CH2:20][CH2:21]3)[C:13](=[O:22])[C:12]2([CH3:23])[CH3:24])[cH:6][cH:7][c:8]1[O:9][CH3:10]참가 물질
3
출처 및 근거
- ORD 기록
- ord-e0bb941c3ced4763a124fdd4b6a8ee64
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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