Ammonium → (+/-)-4-oxo-2-pyrimidin-4-yl-4,6,7,8,9,10-hexahydro-pyrimido[1,2-a]azepine-10-carbothioic acid N-(5-chloro-2-methoxy-phenyl)-amide
반응식
[CH3:19][Si:20]([N-:21][Si:22]([CH3:23])([CH3:24])[CH3:25])([CH3:26])[CH3:27].[Cl-:46].[Cl:29][c:30]1[cH:31][c:32]([N:38]=[C:39]=[S:40])[c:33]([O:36][CH3:37])[cH:34][cH:35]1.[Cl:48][CH2:49][Cl:50].[Li+:28].[NH4+:47].[O:41]1[CH2:42][CH2:43][CH2:44][CH2:45]1.[n:1]1[cH:2][n:3][c:4](-[c:7]2[n:8][c:9]3[n:10]([c:16](=[O:18])[cH:17]2)[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15]3)[cH:5][cH:6]1>>[n:1]1[cH:2][n:3][c:4](-[c:7]2[n:8][c:9]3[n:10]([c:16](=[O:18])[cH:17]2)[CH2:11][CH2:12][CH2:13][CH2:14][CH:15]3[C:39]([NH:38][c:32]2[cH:31][c:30]([Cl:29])[cH:35][cH:34][c:33]2[O:36][CH3:37])=[S:40])[cH:5][cH:6]1참가 물질
9
반응물 8
생성물 1
출처 및 근거
- ORD 기록
- ord-5d4b80cfe82d4404bf93467f8c6f0518
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
반응 노트
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