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Tetrahydrofuran → Tert-butyl 4-(3-cyano-1-(4-(methylsulfonyl)phenyl)-6-oxo-1,6-dihydropyridazin-4-yloxy)piperidine-1-carboxylate

HRID 1559204
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반응식

HRID 1559204 반응식
[C:1]([NH2:2])(=[O:3])[c:4]1[n:5][n:6](-[c:25]2[cH:26][cH:27][c:28]([S:31](=[O:32])(=[O:33])[CH3:34])[cH:29][cH:30]2)[c:7](=[O:24])[cH:8][c:9]1[O:10][CH:11]1[CH2:12][CH2:13][N:14]([C:17](=[O:18])[O:19][C:20]([CH3:21])([CH3:22])[CH3:23])[CH2:15][CH2:16]1.[CH2:48]1[O:49][CH2:50][CH2:51][CH2:52]1.[F:35][C:36]([F:37])([F:38])[C:39]([O:40][C:41](=[O:42])[C:43]([F:44])([F:45])[F:46])=[O:47]>>[C:1](#[N:2])[c:4]1[n:5][n:6](-[c:25]2[cH:26][cH:27][c:28]([S:31](=[O:32])(=[O:33])[CH3:34])[cH:29][cH:30]2)[c:7](=[O:24])[cH:8][c:9]1[O:10][CH:11]1[CH2:12][CH2:13][N:14]([C:17](=[O:18])[O:19][C:20]([CH3:21])([CH3:22])[CH3:23])[CH2:15][CH2:16]1
참가 물질출처 및 근거반응 노트

참가 물질

4

반응물 3

HCID 8028TetrahydrofuranHCID 9845Trifluoroacetic anhydrideHCID 67446737Tert-butyl 4-(3-carbamoyl-1-(4-(methylsulfonyl)phenyl)-6-oxo-1,6-dihydropyridazin-4-yloxy)piperidine-1-carboxylate

생성물 1

HCID 44620998Tert-butyl 4-(3-cyano-1-(4-(methylsulfonyl)phenyl)-6-oxo-1,6-dihydropyridazin-4-yloxy)piperidine-1-carboxylate

출처 및 근거

ORD 기록
ord-27e1a400cfd44cd69f503265d3f6e2db
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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