Hydrochloric Acid → 4-[5-(1-Isopropyl-piperidin-4-yloxy)-6-methyl-1H-indole-2-carbonyl]-piperazine-1-carboxylic acid ethyl ester
反応式
[CH2:25]([CH3:26])[O:27][C:28](=[O:29])[N:30]1[CH2:31][CH2:32][NH:33][CH2:34][CH2:35]1.[CH:2]([CH3:3])([CH3:4])[N:5]1[CH2:6][CH2:7][CH:8]([O:11][c:12]2[cH:13][c:14]3[cH:15][c:16]([C:22](=[O:23])[OH:24])[nH:17][c:18]3[cH:19][c:20]2[CH3:21])[CH2:9][CH2:10]1.[ClH:1]>>[CH:2]([CH3:3])([CH3:4])[N:5]1[CH2:6][CH2:7][CH:8]([O:11][c:12]2[cH:13][c:14]3[cH:15][c:16]([C:22](=[O:24])[N:33]4[CH2:32][CH2:31][N:30]([C:28]([O:27][CH2:25][CH3:26])=[O:29])[CH2:35][CH2:34]4)[nH:17][c:18]3[cH:19][c:20]2[CH3:21])[CH2:9][CH2:10]1参加物
4
出典と根拠
- ORDレコード
- ord-9b20a3e4a4674d2fb23f2a54472b5c57
- 出典データセット
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)