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Dichloromethane → Methyl 5-[methyl(propan-2-yl)amino]-2-[2-oxo-3-[[3-(trifluoromethyl)benzoyl]amino]pyrrolidin-1-yl]cyclohexane-1-carboxylate

HRID 1544717
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HRID 1544717 반응식
[CH3:36][CH2:37][N:38]=[C:39]=[N:40][CH2:41][CH2:42][CH2:43][N:44]([CH3:45])[CH3:46].[CH3:57][CH2:58][N:59]([CH2:60][CH3:61])[CH2:62][CH3:63].[Cl:64][CH2:65][Cl:66].[NH2:1][CH:2]1[C:3](=[O:22])[N:4]([CH:7]2[CH:8]([C:18](=[O:19])[O:20][CH3:21])[CH2:9][CH:10]([N:13]([CH3:14])[CH:15]([CH3:16])[CH3:17])[CH2:11][CH2:12]2)[CH2:5][CH2:6]1.[OH:23][C:24](=[O:25])[c:26]1[cH:27][cH:28][cH:29][c:30]([C:32]([F:33])([F:34])[F:35])[cH:31]1.[OH:47][n:48]1[c:49]2[c:50]([cH:51][cH:52][cH:53][cH:54]2)[n:55][n:56]1>>[NH:1]([CH:2]1[C:3](=[O:22])[N:4]([CH:7]2[CH:8]([C:18](=[O:19])[O:20][CH3:21])[CH2:9][CH:10]([N:13]([CH3:14])[CH:15]([CH3:16])[CH3:17])[CH2:11][CH2:12]2)[CH2:5][CH2:6]1)[C:24](=[O:23])[c:26]1[cH:27][cH:28][cH:29][c:30]([C:32]([F:33])([F:34])[F:35])[cH:31]1
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참가 물질

7

반응물 6

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 99633-(Trifluoromethyl)benzoic acidHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 21074843Methyl 2-(3-amino-2-oxopyrrolidin-1-yl)-5-[methyl(propan-2-yl)amino]cyclohexane-1-carboxylate

생성물 1

HCID 21075017
Methyl 5-[methyl(propan-2-yl)amino]-2-[2-oxo-3-[[3-(trifluoromethyl)benzoyl]amino]pyrrolidin-1-yl]cyclohexane-1-carboxylate

출처 및 근거

ORD 기록
ord-6f27dcc089464bf7a812d8c9fc5577ab
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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