Dichloromethane → ethyl 2-[[3-[4-(3-chlorophenyl)phenyl]-1-[methyl(2H-tetrazol-5-yl)amino]-1-oxopropan-2-yl]amino]propanoate

반응식

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

참가 물질

반응물 3

HCID 6344Dichloromethane

HCID 6422Trifluoroacetic acid

HCID 178471994HCID 178471994, 화합물

생성물 1

HCID 178471995ethyl 2-[[3-[4-(3-chlorophenyl)phenyl]-1-[methyl(2H-tetrazol-5-yl)amino]-1-oxopropan-2-yl]amino]propanoate

출처 및 근거

ORD 기록: ord-b6fa91248c2b46a082868f202810ebde
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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