1,2,4-Trifluoro-5-nitrobenzene → 2-(4,5-Difluoro-2-nitro-phenylamino)-benzo[b]thiophene-3-carbonitrile

반응식

[F:13][c:14]1[c:15]([N+:22](=[O:23])[O-:24])[cH:16][c:17]([F:21])[c:18]([F:20])[cH:19]1.[NH2:1][c:2]1[c:3]([C:11]#[N:12])[c:4]2[c:5]([s:6]1)[cH:7][cH:8][cH:9][cH:10]2>>[NH:1]([c:2]1[c:3]([C:11]#[N:12])[c:4]2[c:5]([s:6]1)[cH:7][cH:8][cH:9][cH:10]2)[c:14]1[c:15]([N+:22](=[O:23])[O-:24])[cH:16][c:17]([F:21])[c:18]([F:20])[cH:19]1

참가 물질

반응물 2

HCID 750121,2,4-Trifluoro-5-nitrobenzene

HCID 232735812-Amino-1-benzothiophene-3-carbonitrile

생성물 1

HCID 184222662-(4,5-Difluoro-2-nitro-phenylamino)-benzo[b]thiophene-3-carbonitrile

출처 및 근거

ORD 기록: ord-bb2101b4de9e48d1ab7539275527cc7d
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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