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Pyridine → 3-n-Butylaminocarbonyloxy-2-(7-chloro-1,8-naphthyridin-2-yl)-5-trifluoromethyl-isoindolin-1-one

HRID 1209766
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반응식

HRID 1209766 반응식
[CH3:40][CH2:41][N:42]([CH2:43][CH3:44])[CH2:45][CH3:46].[CH3:47][C:48]#[N:49].[CH3:7][CH2:8][CH2:9][CH2:10][N:11]=[C:12]=[O:13].[Cl:14][c:15]1[cH:16][cH:17][c:18]2[cH:19][cH:20][c:21]([N:25]3[C:26](=[O:39])[c:27]4[cH:28][cH:29][c:30]([C:35]([F:36])([F:37])[F:38])[cH:31][c:32]4[CH:33]3[OH:34])[n:22][c:23]2[n:24]1.[cH:1]1[cH:2][cH:3][n:4][cH:5][cH:6]1>>[CH3:7][CH2:8][CH2:9][CH2:10][NH:11][C:12](=[O:13])[O:34][CH:33]1[N:25]([c:21]2[cH:20][cH:19][c:18]3[cH:17][cH:16][c:15]([Cl:14])[n:24][c:23]3[n:22]2)[C:26](=[O:39])[c:27]2[cH:28][cH:29][c:30]([C:35]([F:36])([F:37])[F:38])[cH:31][c:32]21
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 1049PyridineHCID 6342AcetonitrileHCID 8110Butyl isocyanateHCID 8471TriethylamineHCID 227547132-(7-Chloro-1,8-naphthyridin-2-yl)-3-hydroxy-5-trifluoromethyl-isoindolin-1-one

생성물 1

HCID 227547593-n-Butylaminocarbonyloxy-2-(7-chloro-1,8-naphthyridin-2-yl)-5-trifluoromethyl-isoindolin-1-one

출처 및 근거

ORD 기록
ord-3736a3b53b7f4c398cee1f1fb84161b1
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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