2-amino-N-(5-chloropyridin-2-yl)-5-fluorobenzamide → Tert-butyl 4-[5-tert-butyl-2-[[2-[(5-chloro-2-pyridinyl)carbamoyl]-4-fluorophenyl]carbamoyl]phenoxy]piperidine-1-carboxylate

반응식

[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([O:14][CH:15]2[CH2:16][CH2:17][N:18]([C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[CH2:19][CH2:20]2)[c:8]([C:9](=[O:10])[Cl:11])[cH:12][cH:13]1.[Cl:28][c:29]1[cH:30][cH:31][c:32]([NH:35][C:36]([c:37]2[c:38]([NH2:44])[cH:39][cH:40][c:41]([F:43])[cH:42]2)=[O:45])[n:33][cH:34]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([O:14][CH:15]2[CH2:16][CH2:17][N:18]([C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[CH2:19][CH2:20]2)[c:8]([C:9](=[O:10])[NH:44][c:38]2[c:37]([C:36]([NH:35][c:32]3[cH:31][cH:30][c:29]([Cl:28])[cH:34][n:33]3)=[O:45])[cH:42][c:41]([F:43])[cH:40][cH:39]2)[cH:12][cH:13]1

참가 물질

반응물 2

HCID 219063152-amino-N-(5-chloropyridin-2-yl)-5-fluorobenzamide

HCID 866102604-tert-butyl-2-(1-Boc-piperidin-4-yloxy)benzoyl chloride

생성물 1

HCID 68535476Tert-butyl 4-[5-tert-butyl-2-[[2-[(5-chloro-2-pyridinyl)carbamoyl]-4-fluorophenyl]carbamoyl]phenoxy]piperidine-1-carboxylate

출처 및 근거

ORD 기록: ord-c212c894b55141c0833a42e1a0222bd4
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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