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4-(Trifluoromethyl)benzenecarbothioyl chloride → N-[2-(5-bromo-4-fluoro-7-methyl-2H-benzotriazol-2-yl)-1-cyano-1-methylethyl]-4-trifluoromethylthiobenzamide

HRID 191771
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인쇄 미리보기

반응식

HRID 191771 반응식
[F:19][C:20]([c:21]1[cH:22][cH:23][c:24]([C:25](=[S:26])[Cl:27])[cH:28][cH:29]1)([F:30])[F:31].[NH2:1][C:2]([C:3]#[N:4])([CH2:5][n:6]1[n:7][c:8]2[c:9]([n:10]1)[c:11]([CH3:17])[cH:12][c:13]([Br:16])[c:14]2[F:15])[CH3:18]>>[NH:1]([C:2]([C:3]#[N:4])([CH2:5][n:6]1[n:7][c:8]2[c:9]([n:10]1)[c:11]([CH3:17])[cH:12][c:13]([Br:16])[c:14]2[F:15])[CH3:18])[C:25]([c:24]1[cH:23][cH:22][c:21]([C:20]([F:19])([F:30])[F:31])[cH:29][cH:28]1)=[S:26]
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참가 물질

3

반응물 2

HCID 198624844-(Trifluoromethyl)benzenecarbothioyl chlorideHCID 666204682-amino-3-(5-bromo-4-fluoro-7-methyl-2H-benzotriazol-2-yl)-2-methylpropionitrile

생성물 1

HCID 86625567N-[2-(5-bromo-4-fluoro-7-methyl-2H-benzotriazol-2-yl)-1-cyano-1-methylethyl]-4-trifluoromethylthiobenzamide

출처 및 근거

ORD 기록
ord-34d5008d30414f45b7e9c1b85115cfe9
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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