Water → 2-[2-(2-Thiazolylmethylthio)ethylamino]-5-(3-methoxybenzyl)-4-pyrimidone

반응식

[N+:11]([NH:12][c:15]1[n:16][cH:17][c:18]([CH2:22][c:23]2[cH:24][c:25]([O:29][CH3:30])[cH:26][cH:27][cH:28]2)[c:19](=[O:21])[nH:20]1)([O-:13])=[O:14].[OH2:31].[s:1]1[c:2]([CH2:6][S:7][CH2:8][CH2:9][NH2:10])[n:3][cH:4][cH:5]1>>[s:1]1[c:2]([CH2:6][S:7][CH2:8][CH2:9][NH:10][c:15]2[n:16][cH:17][c:18]([CH2:22][c:23]3[cH:24][c:25]([O:29][CH3:30])[cH:26][cH:27][cH:28]3)[c:19](=[O:21])[nH:20]2)[n:3][cH:4][cH:5]1

참가 물질

반응물 3

HCID 962Water

HCID 129234032-[(Thiazol-2-yl)methylthio]ethylamine

HCID 202792742-Nitroamino-5-(3-methoxybenzyl)-4-pyrimidone

생성물 1

HCID 129515562-[2-(2-Thiazolylmethylthio)ethylamino]-5-(3-methoxybenzyl)-4-pyrimidone

출처 및 근거

ORD 기록: ord-52fc7dcc61ad48869df9fbb36842dba5
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

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