Dimethyl Sulfoxide → 1-ethyl-N-(cyclohexylmethyl)-1H-pyrazolo[3,4-b]quinolin-4-amine

반응식

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

참가 물질

반응물 3

HCID 679Dimethyl Sulfoxide

HCID 76688Cyclohexanemethylamine

HCID 158169081-ethyl-4-chloro-1H-pyrazolo[3,4-b]quinoline

생성물 1

HCID 99047131-ethyl-N-(cyclohexylmethyl)-1H-pyrazolo[3,4-b]quinolin-4-amine

출처 및 근거

ORD 기록: ord-e6ca4fa5f0704bd2872ad6873bc6d260
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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