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Tetrahydrofuran → 3-(2,6-Dichlorophenyl)-N-(4-{4-[3-(isobutyrylamino)phenyl]-1-piperidinyl}butyl)-5-methyl-4-isoxazolecarboxamide

HRID 2348675
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HRID 2348675 반응식
[CH2:41]1[O:42][CH2:43][CH2:44][CH2:45]1.[Cl:24][c:25]1[c:26](-[c:32]2[n:33][o:34][c:35]([CH3:40])[c:36]2[C:37](=[O:38])[Cl:39])[c:27]([Cl:31])[cH:28][cH:29][cH:30]1.[NH2:1][CH2:2][CH2:3][CH2:4][CH2:5][N:6]1[CH2:7][CH2:8][CH:9]([c:12]2[cH:13][c:14]([NH:18][C:19]([CH:20]([CH3:21])[CH3:22])=[O:23])[cH:15][cH:16][cH:17]2)[CH2:10][CH2:11]1>>[NH:1]([CH2:2][CH2:3][CH2:4][CH2:5][N:6]1[CH2:7][CH2:8][CH:9]([c:12]2[cH:13][c:14]([NH:18][C:19]([CH:20]([CH3:21])[CH3:22])=[O:23])[cH:15][cH:16][cH:17]2)[CH2:10][CH2:11]1)[C:37]([c:36]1[c:32](-[c:26]2[c:25]([Cl:24])[cH:30][cH:29][cH:28][c:27]2[Cl:31])[n:33][o:34][c:35]1[CH3:40])=[O:38]
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반응물 3

HCID 8028TetrahydrofuranHCID 782123-(2,6-Dichlorophenyl)-5-methylisoxazole-4-carbonyl chlorideHCID 16757471N-{3-[1-(4-Aminobutyl)4-piperidinyl]phenyl}-2-methylpropanamide

생성물 1

HCID 220486913-(2,6-Dichlorophenyl)-N-(4-{4-[3-(isobutyrylamino)phenyl]-1-piperidinyl}butyl)-5-methyl-4-isoxazolecarboxamide

출처 및 근거

ORD 기록
ord-41ff9895b0824392aeda66724a5a7fc2
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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