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Methanol → 6-{5-[(cyclopropylamino)carbonyl]-3-fluoro-2-methylphenyl}-N-(1,1-dimethylethyl)-3-pyridinecarboxamide 1-oxide

HRID 2344748
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반응식

HRID 2344748 반응식
[CH3:43][OH:44].[CH:12]1([NH:15][C:16](=[O:17])[c:18]2[cH:19][c:20]([F:38])[c:21]([CH3:37])[c:22](-[c:24]3[cH:25][cH:26][c:27]([C:30](=[O:31])[NH:32][C:33]([CH3:34])([CH3:35])[CH3:36])[cH:28][n:29]3)[cH:23]2)[CH2:13][CH2:14]1.[CH:39]([Cl:40])([Cl:41])[Cl:42].[OH:1][O:2][C:3]([c:4]1[cH:5][c:6]([Cl:7])[cH:8][cH:9][cH:10]1)=[O:11]>>[O-:1][n+:29]1[c:24](-[c:22]2[c:21]([CH3:37])[c:20]([F:38])[cH:19][c:18]([C:16]([NH:15][CH:12]3[CH2:13][CH2:14]3)=[O:17])[cH:23]2)[cH:25][cH:26][c:27]([C:30](=[O:31])[NH:32][C:33]([CH3:34])([CH3:35])[CH3:36])[cH:28]1
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5

반응물 4

HCID 887MethanolHCID 6212ChloroformHCID 70297m-Chloroperbenzoic acidHCID 686803146-{5-[(cyclopropylamino)carbonyl]-3-fluoro-2-methylphenyl}-N-(1,1-dimethylethyl)-3-pyridinecarboxamide

생성물 1

HCID 115238686-{5-[(cyclopropylamino)carbonyl]-3-fluoro-2-methylphenyl}-N-(1,1-dimethylethyl)-3-pyridinecarboxamide 1-oxide

출처 및 근거

ORD 기록
ord-c2b1365f4920466d99f340c825ea4944
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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