Isopropanol → 4-(2-Cyanophenylamino)-3-ethoxycarbonyl-5,8-difluoroquinoline

HRID 1150324

반응식

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

참가 물질

반응물 3

HCID 3776Isopropanol

HCID 729132-Aminobenzonitrile

HCID 17040076Ethyl 4-chloro-5,8-difluoroquinoline-3-carboxylate

생성물 1

HCID 190324854-(2-Cyanophenylamino)-3-ethoxycarbonyl-5,8-difluoroquinoline

출처 및 근거

ORD 기록: ord-d454c94530fd4981a889263efc9927d4
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

연결된 노트

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