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Dimethylformamide → [4-chloro-8-oxo-9-(2,2,2-trifluoroethyl)-3,6,7,10-tetrahydropyrazolo[3,4-i][2]benzazepin-7-yl] 4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxylate

HRID 802433
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인쇄 미리보기

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HRID 802433 반응식
[C:1]([O:2][CH:3]1[CH2:4][c:5]2[c:6]([c:7]3[cH:8][n:9][nH:10][c:11]3[c:12]([Cl:14])[cH:13]2)[CH2:15][N:16]([CH2:19][C:20]([F:21])([F:22])[F:23])[C:17]1=[O:18])([O:24][c:25]1[cH:26][cH:27][c:28]([N+:29]([O-:30])=[O:31])[cH:32][cH:33]1)=[O:34].[CH3:40][CH2:41][N:42]([CH2:43][CH3:44])[CH2:45][CH3:46].[NH:47]1[CH2:48][CH2:49][CH:50]([n:53]2[c:54](=[O:62])[nH:55][c:56]3[n:57][cH:58][cH:59][cH:60][c:61]23)[CH2:51][CH2:52]1.[O:35]=[CH:36][N:37]([CH3:38])[CH3:39]>>[C:1]([O:2][CH:3]1[CH2:4][c:5]2[c:6]([c:7]3[cH:8][n:9][nH:10][c:11]3[c:12]([Cl:14])[cH:13]2)[CH2:15][N:16]([CH2:19][C:20]([F:21])([F:22])[F:23])[C:17]1=[O:18])(=[O:34])[N:47]1[CH2:48][CH2:49][CH:50]([n:53]2[c:54](=[O:62])[nH:55][c:56]3[n:57][cH:58][cH:59][cH:60][c:61]23)[CH2:51][CH2:52]1
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반응물 4

HCID 6228DimethylformamideHCID 8471TriethylamineHCID 22293182Bms-973013HCID 67319329[4-Chloro-8-oxo-9-(2,2,2-trifluoroethyl)-3,6,7,10-tetrahydropyrazolo[3,4-i][2]benzazepin-7-yl] (4-nitrophenyl) carbonate

생성물 1

HCID 68963302[4-chloro-8-oxo-9-(2,2,2-trifluoroethyl)-3,6,7,10-tetrahydropyrazolo[3,4-i][2]benzazepin-7-yl] 4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxylate

출처 및 근거

ORD 기록
ord-05c34993b7d64ecf8093f7ab55cdcd3e
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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