2-[(2-Amino-3-phenylpropyl)amino]-3-methyl-5-nitro-6-pyridin-4-ylpyrimidin-4-one → 5-amino-2-(2-amino-3-phenyl-propylamino)-3-methyl-6-pyridin-4-yl-3H-pyrimidin-4-one

반응식

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

참가 물질

반응물 2

HCID 235747012-[(2-Amino-3-phenylpropyl)amino]-3-methyl-5-nitro-6-pyridin-4-ylpyrimidin-4-one

HCID 178418361HCID 178418361, 화합물

생성물 1

HCID 221396105-amino-2-(2-amino-3-phenyl-propylamino)-3-methyl-6-pyridin-4-yl-3H-pyrimidin-4-one

출처 및 근거

ORD 기록: ord-be32018a8ce54db594e93d9ff4552cf6
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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