Pyridine → 2-[3-(5-Chloro-3-methylpyrid-2-ylamino)propylamino]-5-(4-pyridylmethyl)-4-pyrimidone

반응식

[CH3:14][S:15][c:16]1[n:17][cH:18][c:19]([CH2:23][c:24]2[cH:25][cH:26][n:27][cH:28][cH:29]2)[c:20](=[O:22])[nH:21]1.[NH2:1][CH2:2][CH2:3][CH2:4][NH:5][c:6]1[n:7][cH:8][c:9]([Cl:13])[cH:10][c:11]1[CH3:12].[cH:30]1[cH:31][cH:32][n:33][cH:34][cH:35]1>>[NH:1]([CH2:2][CH2:3][CH2:4][NH:5][c:6]1[n:7][cH:8][c:9]([Cl:13])[cH:10][c:11]1[CH3:12])[c:16]1[n:17][cH:18][c:19]([CH2:23][c:24]2[cH:25][cH:26][n:27][cH:28][cH:29]2)[c:20](=[O:22])[nH:21]1

참가 물질

반응물 3

HCID 1049Pyridine

HCID 143385852-(Methylthio)-5-(pyridin-4-ylmethyl)pyrimidin-4(1H)-one

HCID 143973652-(3-Aminopropylamino)-5-chloro-3-methylpyridine

생성물 1

HCID 202122372-[3-(5-Chloro-3-methylpyrid-2-ylamino)propylamino]-5-(4-pyridylmethyl)-4-pyrimidone

출처 및 근거

ORD 기록: ord-c7df3aeb25304a649e9da26981db437c
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

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