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Tetrahydrofuran → 3-({5-Chloro-3-[(4-chloro-3-trifluoromethyl-benzenesulfonyl)-methoxymethyl-amino]-pyridine-2-carbonyl}-isopropyl-amino)-pyrazole-1-carboxylic acid tert-butyl ester

HRID 151128
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인쇄 미리보기

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HRID 151128 반응식
[C:29]([CH3:30])([CH3:31])([CH3:32])[O:33][C:34](=[O:35])[n:36]1[n:37][c:38]([NH:41][CH:42]([CH3:43])[CH3:44])[cH:39][cH:40]1.[CH2:45]1[O:46][CH2:47][CH2:48][CH2:49]1.[Cl:1][c:2]1[cH:3][c:4]([N:11]([CH2:12][O:13][CH3:14])[S:15](=[O:16])(=[O:17])[c:18]2[cH:19][c:20]([C:25]([F:26])([F:27])[F:28])[c:21]([Cl:24])[cH:22][cH:23]2)[c:5]([C:8](=[O:9])[Cl:10])[n:6][cH:7]1>>[Cl:1][c:2]1[cH:3][c:4]([N:11]([CH2:12][O:13][CH3:14])[S:15](=[O:16])(=[O:17])[c:18]2[cH:19][c:20]([C:25]([F:26])([F:27])[F:28])[c:21]([Cl:24])[cH:22][cH:23]2)[c:5]([C:8](=[O:9])[N:41]([c:38]2[n:37][n:36]([C:34]([O:33][C:29]([CH3:30])([CH3:31])[CH3:32])=[O:35])[cH:40][cH:39]2)[CH:42]([CH3:43])[CH3:44])[n:6][cH:7]1
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반응물 3

HCID 8028TetrahydrofuranHCID 579422415-Chloro-3-[(4-chloro-3-trifluoromethyl-benzenesulfonyl)-methoxymethyl-amino]-pyridine-2-carbonyl chlorideHCID 579422763-Isopropylamino-pyrazole-1-carboxylic acid tert-butyl ester

생성물 1

HCID 579421893-({5-Chloro-3-[(4-chloro-3-trifluoromethyl-benzenesulfonyl)-methoxymethyl-amino]-pyridine-2-carbonyl}-isopropyl-amino)-pyrazole-1-carboxylic acid tert-butyl ester

출처 및 근거

ORD 기록
ord-a60ed0fcba804dcd868a48bece5bf5c4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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