Diisopropylethylamine → 5-Cyano-furan-2-carboxylic Acid [2-(4,4-difluoro-piperidin-1-yl)-phenyl]-amide

반응식

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

참가 물질

반응물 3

HCID 81531Diisopropylethylamine

HCID 202590395-Cyano-2-furoyl chloride

HCID 693077102-(4,4-Difluoropiperidin-1-yl)aniline

생성물 1

HCID 116599595-Cyano-furan-2-carboxylic Acid [2-(4,4-difluoro-piperidin-1-yl)-phenyl]-amide

출처 및 근거

ORD 기록: ord-a721278b58ae4f3f867ea63fbbc832ff
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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