Acetonitrile → 5-(4-Chlorobutyramido)-4-cyano-1-(2,3,4-trichlorophenyl)pyrazole

반응식

[CH3:25][C:26]#[N:27].[Cl:18][CH2:19][CH2:20][CH2:21][C:22](=[O:23])[Cl:24].[NH2:1][c:2]1[c:3]([C:16]#[N:17])[cH:4][n:5][n:6]1-[c:7]1[c:8]([Cl:15])[c:9]([Cl:14])[c:10]([Cl:13])[cH:11][cH:12]1>>[NH:1]([c:2]1[c:3]([C:16]#[N:17])[cH:4][n:5][n:6]1-[c:7]1[c:8]([Cl:15])[c:9]([Cl:14])[c:10]([Cl:13])[cH:11][cH:12]1)[C:22]([CH2:21][CH2:20][CH2:19][Cl:18])=[O:23]

참가 물질

반응물 3

HCID 6342Acetonitrile

HCID 783704-Chlorobutyryl chloride

HCID 30189015-amino-1-(2,3,4-trichlorophenyl)-1H-pyrazole-4-carbonitrile

생성물 1

HCID 131276425-(4-Chlorobutyramido)-4-cyano-1-(2,3,4-trichlorophenyl)pyrazole

출처 및 근거

ORD 기록: ord-ff81c42c67124caba32e21a2afcfd4a2
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

반응 노트

불러오는 중…