Hydrochloric Acid → N-[1-(Cyanomethyl-carbamoyl)-cyclohexyl]-4-(4-isopropyl-piperazin-1-yl)-benzamide
반응식
[C:1](#[N:2])[CH2:3][NH:4][C:5](=[O:6])[C:7]1([NH2:13])[CH2:8][CH2:9][CH2:10][CH2:11][CH2:12]1.[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[CH:15]([CH3:16])([CH3:17])[N:18]1[CH2:19][CH2:20][N:21]([c:24]2[cH:25][cH:26][c:27]([C:28](=[O:29])[OH:30])[cH:31][cH:32]2)[CH2:22][CH2:23]1.[ClH:14].[O:50]=[CH:51][N:52]([CH3:53])[CH3:54].[OH:33][n:34]1[c:35]2[c:36]([cH:37][cH:38][cH:39][cH:40]2)[n:41][n:42]1>>[C:1](#[N:2])[CH2:3][NH:4][C:5](=[O:6])[C:7]1([NH:13][C:28]([c:27]2[cH:26][cH:25][c:24]([N:21]3[CH2:20][CH2:19][N:18]([CH:15]([CH3:16])[CH3:17])[CH2:23][CH2:22]3)[cH:32][cH:31]2)=[O:29])[CH2:8][CH2:9][CH2:10][CH2:11][CH2:12]1참가 물질
7
반응물 6
생성물 1
출처 및 근거
- ORD 기록
- ord-13fab19f1d8a45728714078c34eefb72
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
반응 노트
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