Acetic Acid → 3-cyano-N-[2-(3,4-dichlorophenyl)-4-[4-(2-methylsulfinylphenyl)piperidin-1-yl]butyl]-N-methylnaphthalene-1-carboxamide
반응식
[C:1](#[N:2])[c:3]1[cH:4][c:5]([C:13](=[O:14])[OH:15])[c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]2[cH:12]1.[CH3:32][N:33]([CH3:34])[C:35]([F:36])=[N+:37]([CH3:38])[CH3:39].[CH3:72][C:73](=[O:74])[OH:75].[CH:16]([N:17]([CH2:18][CH3:19])[CH:20]([CH3:21])[CH3:22])([CH3:23])[CH3:24].[Cl:40][c:41]1[cH:42][c:43]([CH:48]([CH2:49][NH:50][CH3:51])[CH2:52][CH2:53][N:54]2[CH2:55][CH2:56][CH:57]([c:60]3[c:61]([S:66](=[O:67])[CH3:68])[cH:62][cH:63][cH:64][cH:65]3)[CH2:58][CH2:59]2)[cH:44][cH:45][c:46]1[Cl:47].[Cl:69][CH2:70][Cl:71].[P-:25]([F:26])([F:27])([F:28])([F:29])([F:30])[F:31]>>[C:1](#[N:2])[c:3]1[cH:4][c:5]([C:13](=[O:15])[N:50]([CH2:49][CH:48]([c:43]2[cH:42][c:41]([Cl:40])[c:46]([Cl:47])[cH:45][cH:44]2)[CH2:52][CH2:53][N:54]2[CH2:55][CH2:56][CH:57]([c:60]3[c:61]([S:66](=[O:67])[CH3:68])[cH:62][cH:63][cH:64][cH:65]3)[CH2:58][CH2:59]2)[CH3:51])[c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]2[cH:12]1참가 물질
8
반응물 7
생성물 1
출처 및 근거
- ORD 기록
- ord-393520fc65814aca9987814975997b3c
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
반응 노트
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