Ethanol → 5-Acetyl-2-ethyl-4-(1H-indazol-7-ylamino)-6-phenylpyridazin-3(2H)-one

반응식

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

참가 물질

반응물 3

HCID 702Ethanol

HCID 889011H-indazol-7-amine

HCID 107320155-acetyl-2-ethylnitro6-phenylpyridazin-3(2H)-one

생성물 1

HCID 684883025-Acetyl-2-ethyl-4-(1H-indazol-7-ylamino)-6-phenylpyridazin-3(2H)-one

출처 및 근거

ORD 기록: ord-950a7786a3d84343bbfde676063b5247
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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