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Bicarbonate Ion → N-(cyanomethyl)-4-methyl-2-{[4'-(1-piperazinyl)[1,1'-biphenyl]-2-yl]methyl}pentanamide

HRID 804660
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인쇄 미리보기

반응식

HRID 804660 반응식
[C:1](#[N:2])[CH2:3][NH:4][C:5](=[O:6])[CH:7]([CH2:8][c:9]1[c:10](-[c:15]2[cH:16][cH:17][c:18]([N:21]3[CH2:22][CH2:23][N:24]([C:27]([O:28][C:29]([CH3:30])([CH3:31])[CH3:32])=[O:33])[CH2:25][CH2:26]3)[cH:19][cH:20]2)[cH:11][cH:12][cH:13][cH:14]1)[CH2:34][CH:35]([CH3:36])[CH3:37].[CH2:43]1[O:44][CH2:45][CH2:46][CH2:47]1.[Na+:42].[O-:38][C:39]([OH:40])=[O:41]>>[C:1](#[N:2])[CH2:3][NH:4][C:5](=[O:6])[CH:7]([CH2:8][c:9]1[c:10](-[c:15]2[cH:16][cH:17][c:18]([N:21]3[CH2:22][CH2:23][NH:24][CH2:25][CH2:26]3)[cH:19][cH:20]2)[cH:11][cH:12][cH:13][cH:14]1)[CH2:34][CH:35]([CH3:36])[CH3:37]
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5

반응물 4

HCID 769Bicarbonate IonHCID 923Sodium IonHCID 8028TetrahydrofuranHCID 22235962Tert-butyl 4-[2'-(2-{[(cyanomethyl)amino]carbonyl}-4-methylpentyl)[1,1'-biphenyl]-4-yl]-1-piperazinecarboxylate

생성물 1

HCID 10158123N-(cyanomethyl)-4-methyl-2-{[4'-(1-piperazinyl)[1,1'-biphenyl]-2-yl]methyl}pentanamide

출처 및 근거

ORD 기록
ord-e0ec8937b02642ebb0135f60486d5032
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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