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Chloride → 2-(3-chloro-4-methylsulfonylphenyl)-N-[1-(2-methoxy-2-methylpropyl)pyrazol-3-yl]-3-(3-oxocyclobutyl)propanamide

HRID 2142494
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HRID 2142494 반응식
[CH2:49]([Cl:50])[Cl:51].[CH3:28][O:29][C:30]([CH2:31][n:32]1[n:33][c:34]([NH2:37])[cH:35][cH:36]1)([CH3:38])[CH3:39].[Cl-:48].[Cl:1][c:2]1[cH:3][c:4]([CH:12]([C:13](=[O:14])[OH:15])[CH2:16][CH:17]2[CH2:18][C:19](=[O:21])[CH2:20]2)[cH:5][cH:6][c:7]1[S:8](=[O:9])(=[O:10])[CH3:11].[Cl:22][C:23]([C:24]([Cl:25])=[O:26])=[O:27].[n:40]1[c:41]([CH3:42])[cH:43][cH:44][cH:45][c:46]1[CH3:47]>>[Cl:1][c:2]1[cH:3][c:4]([CH:12]([C:13](=[O:15])[NH:37][c:34]2[n:33][n:32]([CH2:31][C:30]([O:29][CH3:28])([CH3:38])[CH3:39])[cH:36][cH:35]2)[CH2:16][CH:17]2[CH2:18][C:19](=[O:21])[CH2:20]2)[cH:5][cH:6][c:7]1[S:8](=[O:9])(=[O:10])[CH3:11]
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반응물 6

HCID 312ChlorideHCID 6344DichloromethaneHCID 79372,6-LutidineHCID 65578Oxalyl chlorideHCID 668999341-(2-methoxy-2-methylpropyl)-1H-pyrazol-3-amineHCID 671913502-(3-Chloro-4-methylsulfonylphenyl)-3-(3-oxocyclobutyl)propanoic acid

생성물 1

HCID 67188467
2-(3-chloro-4-methylsulfonylphenyl)-N-[1-(2-methoxy-2-methylpropyl)pyrazol-3-yl]-3-(3-oxocyclobutyl)propanamide

출처 및 근거

ORD 기록
ord-a312a172a4b64194a69a6c3b20eb2cd9
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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