1-[2-(Trifluoromethyl)benzoyl]piperazine → 4-METHYL-2-({6-[4-(2-TRIFLUOROMETHYLBENZOYL)PIPERAZIN-1-YL]-PYRIDAZINE-3-CARBONYL}AMINO)PENTANOIC Acid Methyl Ester
반응식
[CH3:1][O:2][C:3]([CH:4]([CH2:5][CH:6]([CH3:7])[CH3:8])[NH:9][C:10](=[O:11])[c:12]1[n:13][n:14][c:15]([Cl:18])[cH:16][cH:17]1)=[O:19].[N:20]1([C:26](=[O:27])[c:28]2[c:29]([C:34]([F:35])([F:36])[F:37])[cH:30][cH:31][cH:32][cH:33]2)[CH2:21][CH2:22][NH:23][CH2:24][CH2:25]1>>[CH3:1][O:2][C:3]([CH:4]([CH2:5][CH:6]([CH3:7])[CH3:8])[NH:9][C:10](=[O:11])[c:12]1[n:13][n:14][c:15]([N:23]2[CH2:22][CH2:21][N:20]([C:26](=[O:27])[c:28]3[c:29]([C:34]([F:35])([F:36])[F:37])[cH:30][cH:31][cH:32][cH:33]3)[CH2:25][CH2:24]2)[cH:16][cH:17]1)=[O:19]참가 물질
3
출처 및 근거
- ORD 기록
- ord-b3fec522f8d942d69fffbd1ea1f99fae
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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