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Dichloromethane → Tert-butyl 3-[3-[[2-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentylpropanoyl]amino]pyrazol-1-yl]propanoate

HRID 203012
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HRID 203012 반응식
[C:28]([Cl:29])(=[O:30])[C:31]([Cl:32])=[O:33].[C:42]([CH3:43])([CH3:44])([CH3:45])[O:46][C:47]([CH:48]([n:49]1[cH:50][cH:51][c:52]([NH2:53])[n:54]1)[CH3:55])=[O:56].[CH2:57]([Cl:58])[Cl:59].[Cl:1][c:2]1[cH:3][c:4]([CH:12]([C:13](=[O:14])[NH:15][c:16]2[n:17][n:18]([CH3:21])[cH:19][cH:20]2)[CH2:22][CH:23]2[CH2:24][CH2:25][CH2:26][CH2:27]2)[cH:5][cH:6][c:7]1[S:8](=[O:9])(=[O:10])[CH3:11].[n:34]1[c:35]([CH3:36])[cH:37][cH:38][cH:39][c:40]1[CH3:41]>>[Cl:1][c:2]1[cH:3][c:4]([CH:12]([C:13](=[O:14])[NH:15][c:16]2[n:17][n:18]([CH2:21][CH2:48][C:47]([O:46][C:42]([CH3:43])([CH3:44])[CH3:45])=[O:56])[cH:19][cH:20]2)[CH2:22][CH:23]2[CH2:24][CH2:25][CH2:26][CH2:27]2)[cH:5][cH:6][c:7]1[S:8](=[O:9])(=[O:10])[CH3:11]
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반응물 5

HCID 6344DichloromethaneHCID 79372,6-LutidineHCID 65578Oxalyl chlorideHCID 671896922-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentyl-N-(1-methylpyrazol-3-yl)propanamideHCID 67190546(3-Amino-pyrazol-1-yl)-propionic acid tert-butyl ester

생성물 1

HCID 67189833
Tert-butyl 3-[3-[[2-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentylpropanoyl]amino]pyrazol-1-yl]propanoate

출처 및 근거

ORD 기록
ord-742b765b20da485889c0a13ea596a93c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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