5-(4-Chloro-phenyl)-2-ethynyl-pyridine → HCID 59835912, 화합물
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[Cl:18][c:19]1[cH:20][cH:21][c:22](-[c:25]2[cH:26][cH:27][c:28]([C:31]#[CH:32])[n:29][cH:30]2)[cH:23][cH:24]1.[I:1][c:2]1[cH:3][c:4]2[c:5]([n:6]([CH2:9][CH2:10][N:11]3[CH2:12][CH2:13][CH2:14][CH2:15]3)[cH:7][n:8]2)[cH:16][cH:17]1>>[c:2]1([C:32]#[C:31][c:28]2[cH:27][cH:26][c:25](-[c:22]3[cH:21][cH:20][c:19]([Cl:18])[cH:24][cH:23]3)[cH:30][n:29]2)[cH:3][c:4]2[c:5]([n:6]([CH2:9][CH2:10][N:11]3[CH2:12][CH2:13][CH2:14][CH2:15]3)[cH:7][n:8]2)[cH:16][cH:17]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-f7990d32f4324c9aab1a05852eee4888
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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