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Ammonium → 2-[(2-Chloro-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl)amino]-3-methylbutan-1-ol

HRID 185768
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인쇄 미리보기

반응식

HRID 185768 반응식
[C:19]([CH3:21])([CH3:22])([O:23][OH:20])[CH3:24].[CH3:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH3:43].[CH3:44][CH:45]([CH3:46])[O-:47].[CH3:49][CH:50]([CH3:51])[O-:52].[CH3:53][CH:54]([CH3:55])[O-:56].[CH3:57][CH:58]([CH3:59])[O-:60].[CH:27]([Cl:28])([Cl:29])[Cl:30].[Cl:2][c:3]1[n:4][c:5]([NH:12][CH:13]([CH2:14][OH:15])[CH:16]([CH3:17])[CH3:18])[c:6]2[c:7]([n:8]1)[CH2:9][CH2:10][S:11]2.[Cl:31][CH2:32][Cl:33].[NH4+:26].[OH-:25].[OH2:1].[Ti+4:48]>>[Cl:2][c:3]1[n:4][c:5]([NH:12][CH:13]([CH2:14][OH:15])[CH:16]([CH3:17])[CH3:18])[c:6]2[c:7]([n:8]1)[CH2:9][CH2:10][S:11]2=[O:23]
참가 물질출처 및 근거반응 노트

참가 물질

11

반응물 10

HCID 223AmmoniumHCID 961HydroxideHCID 962WaterHCID 6212ChloroformHCID 6344DichloromethaneHCID 6410tert-Butyl hydroperoxideHCID 15600DecaneHCID 114942Titanium cation (4+)
HCID 3260420
Isopropanolate
4회
HCID 580715972-[(2-Chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl)amino]-3-methylbutan-1-ol

생성물 1

HCID 581234052-[(2-Chloro-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl)amino]-3-methylbutan-1-ol

출처 및 근거

ORD 기록
ord-9e56f0cf67be403a98c596d8d14fc0ed
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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