4-(4-Ethylpiperazin-1-yl)aniline → 8-(2,6-Dimethyl-phenyl)-quinoxaline-5-carboxylic acid [4-(4-ethyl-piperazin-1-yl)phenyl]-amide

반응식

[CH2:1]([CH3:2])[N:3]1[CH2:4][CH2:5][N:6]([c:9]2[cH:10][cH:11][c:12]([NH2:13])[cH:14][cH:15]2)[CH2:7][CH2:8]1.[CH3:16][c:17]1[c:18](-[c:24]2[cH:25][cH:26][c:27]([C:34](=[O:35])[OH:36])[c:28]3[n:29][cH:30][cH:31][n:32][c:33]23)[c:19]([CH3:23])[cH:20][cH:21][cH:22]1>>[CH2:1]([CH3:2])[N:3]1[CH2:4][CH2:5][N:6]([c:9]2[cH:10][cH:11][c:12]([NH:13][C:34]([c:27]3[cH:26][cH:25][c:24](-[c:18]4[c:17]([CH3:16])[cH:22][cH:21][cH:20][c:19]4[CH3:23])[c:33]4[c:28]3[n:29][cH:30][cH:31][n:32]4)=[O:35])[cH:14][cH:15]2)[CH2:7][CH2:8]1

참가 물질

반응물 2

HCID 9367384-(4-Ethylpiperazin-1-yl)aniline

HCID 669145748-(2,6-Dimethyl-phenyl)quinoxaline-5-carboxylic acid

생성물 1

HCID 445166058-(2,6-Dimethyl-phenyl)-quinoxaline-5-carboxylic acid [4-(4-ethyl-piperazin-1-yl)phenyl]-amide

출처 및 근거

ORD 기록: ord-cc992d6e03b2423699c3c28c211e3ac1
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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