Benzyl 2-[3,5-dichloro-2-methyl-6-oxo-1(6H)-pyrazinyl]acetate → Benzyl 2-[3-chloro-5-[[1-(dimethylamino)-3-phenylpropan-2-yl]amino]-2-methyl-6-oxopyrazin-1-yl]acetate

반응식

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

참가 물질

반응물 2

HCID 10663926Benzyl 2-[3,5-dichloro-2-methyl-6-oxo-1(6H)-pyrazinyl]acetate

HCID 11769112N1,N1-Dimethyl-3-phenyl-1,2-propanediamine

생성물 1

HCID 18470833Benzyl 2-[3-chloro-5-[[1-(dimethylamino)-3-phenylpropan-2-yl]amino]-2-methyl-6-oxopyrazin-1-yl]acetate

출처 및 근거

ORD 기록: ord-d56cabe3f4d049b6aa4401a6819afe19
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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