Toluene → 6-(4-Methyl-piperazin-1-yl)-4-o-tolyl-nicotinonitrile

반응식

[CH3:17][N:18]1[CH2:19][CH2:20][NH:21][CH2:22][CH2:23]1.[CH3:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1.[Cl:1][c:2]1[n:3][cH:4][c:5]([C:6]#[N:7])[c:8](-[c:10]2[c:11]([CH3:16])[cH:12][cH:13][cH:14][cH:15]2)[cH:9]1>>[c:2]1([N:21]2[CH2:20][CH2:19][N:18]([CH3:17])[CH2:23][CH2:22]2)[n:3][cH:4][c:5]([C:6]#[N:7])[c:8](-[c:10]2[c:11]([CH3:16])[cH:12][cH:13][cH:14][cH:15]2)[cH:9]1

참가 물질

반응물 3

HCID 1140Toluene

HCID 531671-Methylpiperazine

HCID 113681836-Chloro-4-(o-tolyl)nicotinonitrile

생성물 1

HCID 113807896-(4-Methyl-piperazin-1-yl)-4-o-tolyl-nicotinonitrile

출처 및 근거

ORD 기록: ord-23319892c7ee44b5bcf39358d91adfd6
출처 데이터셋: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D

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