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Sodium Ion → 1-(2-Methylsulfanyl-pyrimidin-4-yl)-7-phenyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one

HRID 86121
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HRID 86121 반응식
[CH3:103][c:104]1[cH:105][cH:106][cH:107][cH:108][cH:109]1.[CH3:1][S:2][c:3]1[n:4][cH:5][cH:6][c:7]([N:9]2[c:10]3[n:11]([c:15](=[O:25])[cH:16][c:17](-[c:19]4[cH:20][cH:21][cH:22][cH:23][cH:24]4)[cH:18]3)[CH2:12][CH2:13][CH2:14]2)[n:8]1.[CH3:42][C:43]([CH3:44])([O-:45])[CH3:46].[Cl:94][c:95]1[cH:96][cH:97][n:98][c:99]([S:100][CH3:101])[n:102]1.[Na+:47].[c:26]1(-[c:27]2[cH:28][c:29]3[n:33]([c:34](=[O:35])[cH:36]2)[CH2:32][CH2:31][NH:30]3)[cH:37][cH:38][cH:39][cH:40][cH:41]1.[cH:48]1[cH:49][cH:50][c:51]([P:52]([c:53]2[cH:54][cH:55][c:56]3[c:57]([cH:58][cH:59][cH:60][cH:61]3)[c:62]2-[c:63]2[c:64]3[c:65]([cH:66][cH:67][cH:68][cH:69]3)[cH:70][cH:71][c:72]2[P:73]([c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)[c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)[c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)[cH:92][cH:93]1>>[CH3:1][S:2][c:3]1[n:4][cH:5][cH:6][c:7]([N:9]2[c:10]3[n:11]([c:15](=[O:25])[cH:16][c:17](-[c:19]4[cH:20][cH:21][cH:22][cH:23][cH:24]4)[cH:18]3)[CH2:12][CH2:14]2)[n:8]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 923Sodium IonHCID 1140TolueneHCID 971134-Chloro-2-methylthiopyrimidineHCID 634876Binap, (A+-)-HCID 3050276Imidazo(1,2-a)pyridin-5(1H)-one, 2,3-dihydro-7-phenyl-HCID 45749132-Methylpropan-2-olate
HCID 57593121
1-(2-Methylsulfanyl-pyrimidin-4-yl)-8-phenyl-1,2,3,4-tetrahydro-pyrido[1,2-a]pyrimidin-6-one

생성물 1

HCID 575931601-(2-Methylsulfanyl-pyrimidin-4-yl)-7-phenyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one

출처 및 근거

ORD 기록
ord-ab920a0b74c04d23aa6b4d8c7f7c9230
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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