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Dichloromethane → 2-(4-{[5-Chloro-2-nitro-4-(trifluoromethyl)phenyl]amino}phenyl)ethyl (4-methylphenyl)sulfonylcarbamate

HRID 1139254
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HRID 1139254 반응식
[Cl:1][c:2]1[c:3]([C:21]([F:22])([F:23])[F:24])[cH:4][c:5]([N+:18](=[O:19])[O-:20])[c:6]([NH:8][c:9]2[cH:10][cH:11][c:12]([CH2:15][CH2:16][OH:17])[cH:13][cH:14]2)[cH:7]1.[Cl:38][CH2:39][Cl:40].[c:25]1([CH3:37])[cH:26][cH:27][c:28]([S:31](=[O:32])(=[O:33])[N:34]=[C:35]=[O:36])[cH:29][cH:30]1>>[Cl:1][c:2]1[c:3]([C:21]([F:22])([F:23])[F:24])[cH:4][c:5]([N+:18](=[O:19])[O-:20])[c:6]([NH:8][c:9]2[cH:10][cH:11][c:12]([CH2:15][CH2:16][O:17][C:35]([NH:34][S:31]([c:28]3[cH:27][cH:26][c:25]([CH3:37])[cH:30][cH:29]3)(=[O:32])=[O:33])=[O:36])[cH:13][cH:14]2)[cH:7]1
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4

반응물 3

HCID 6344DichloromethaneHCID 77703p-Toluenesulfonyl isocyanateHCID 218764722-(4-{[5-Chloro-2-nitro-4-(trifluoromethyl)phenyl]amino}phenyl)ethanol

생성물 1

HCID 866115002-(4-{[5-Chloro-2-nitro-4-(trifluoromethyl)phenyl]amino}phenyl)ethyl (4-methylphenyl)sulfonylcarbamate

출처 및 근거

ORD 기록
ord-43a16dbb696a4bccbaa831da19fb585c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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