Water → 2-(4-Chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]acetamide

반응식

[Cl:1][c:2]1[c:3]([CH:12]([C:13]#[N:14])[c:15]2[cH:16][cH:17][c:18]([Cl:21])[cH:19][cH:20]2)[n:4][cH:5][c:6]([C:8]([F:9])([F:10])[F:11])[cH:7]1.[OH2:27].[S:22]([OH:23])(=[O:24])(=[O:25])[OH:26]>>[Cl:1][c:2]1[c:3]([CH:12]([C:13]([NH2:14])=[O:23])[c:15]2[cH:16][cH:17][c:18]([Cl:21])[cH:19][cH:20]2)[n:4][cH:5][c:6]([C:8]([F:9])([F:10])[F:11])[cH:7]1

참가 물질

반응물 3

HCID 962Water

HCID 1118Sulfuric Acid

HCID 27738272-(4-Chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]acetonitrile

생성물 1

HCID 37609312-(4-Chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]acetamide

출처 및 근거

ORD 기록: ord-06ba7a0d8dc14309b5abd2640f63824d
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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