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Potassium Cation → [2-(6-Benzenesulfonyl-1,2,3,4-tetrahydro-naphthalen-1-ylamino)-ethyl]-methyl-carbamic acid tert-butyl ester

HRID 181823
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인쇄 미리보기

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HRID 181823 반응식
[C:21]([CH3:22])([CH3:23])([CH3:24])[O:25][C:26]([N:27]([CH3:28])[CH2:29][CH2:30][NH2:31])=[O:32].[C:35](=[O:36])([O-:37])[O-:38].[CH3:42][C:43]#[N:44].[I-:34].[K+:39].[K+:40].[Na+:33].[OH2:41].[c:1]1([S:7](=[O:8])(=[O:9])[c:10]2[cH:11][c:12]3[c:17]([cH:18][cH:19]2)[CH:16]([Cl:20])[CH2:15][CH2:14][CH2:13]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([S:7](=[O:8])(=[O:9])[c:10]2[cH:11][c:12]3[c:17]([cH:18][cH:19]2)[CH:16]([NH:31][CH2:30][CH2:29][N:27]([C:26]([O:25][C:21]([CH3:22])([CH3:23])[CH3:24])=[O:32])[CH3:28])[CH2:15][CH2:14][CH2:13]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 813Potassium Cation2회HCID 923Sodium IonHCID 962WaterHCID 6342AcetonitrileHCID 19660Carbonate IonHCID 30165Iodide IonHCID 2756424N-Boc-N-methylethylenediamine
HCID 57526780
6-Benzenesulfonyl-1-chloro-1,2,3,4-tetrahydro-naphthalene

생성물 1

HCID 57804253[2-(6-Benzenesulfonyl-1,2,3,4-tetrahydro-naphthalen-1-ylamino)-ethyl]-methyl-carbamic acid tert-butyl ester

출처 및 근거

ORD 기록
ord-984c58acb2684645bcf4cd3ffb18dd0a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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