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Benzene → 3-[2-[4-(2-Bromo-10,11-dihydro-dibenzo[b,f]thiepin-10-yl)-1-piperazinyl]-ethyl]-2-oxazolidinone

HRID 173145
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인쇄 미리보기

반응식

HRID 173145 반응식
[Br:1][c:2]1[cH:3][c:4]2[c:5]([cH:21][cH:22]1)[S:6][c:7]1[c:8]([cH:17][cH:18][cH:19][cH:20]1)[CH:9]([N:11]1[CH2:12][CH2:13][NH:14][CH2:15][CH2:16]1)[CH2:10]2.[C:23](=[O:24])([O-:25])[O-:26].[CH3:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[Cl:31][CH2:32][CH2:33][N:34]1[C:35](=[O:39])[O:36][CH2:37][CH2:38]1.[I-:30].[K+:27].[K+:28].[K+:29].[cH:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[Br:1][c:2]1[cH:3][c:4]2[c:5]([cH:21][cH:22]1)[S:6][c:7]1[c:8]([cH:17][cH:18][cH:19][cH:20]1)[CH:9]([N:11]1[CH2:12][CH2:13][N:14]([CH2:32][CH2:33][N:34]3[C:35](=[O:39])[O:36][CH2:37][CH2:38]3)[CH2:15][CH2:16]1)[CH2:10]2
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 241BenzeneHCID 813Potassium Cation3회HCID 1140TolueneHCID 19660Carbonate IonHCID 30165Iodide IonHCID 756333-(2-Chloroethyl)-1,3-oxazolidin-2-oneHCID 214811421-(2-Bromo-10,11-dihydro-dibenzo[b,f]thiepin-10-yl)-piperazine

생성물

1
HCID 214811553-[2-[4-(2-Bromo-10,11-dihydro-dibenzo[b,f]thiepin-10-yl)-1-piperazinyl]-ethyl]-2-oxazolidinone

출처 및 근거

ORD 기록
ord-970c317a5f9245daaf79486b8a1768af
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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