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Sodium Ion → 2-Methylsulfanyl-4-(2-morpholin-4-ylethoxy)-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile

HRID 284355
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인쇄 미리보기

반응식

HRID 284355 반응식
[Cl:1][c:2]1[n:3][c:4]([S:21][CH3:22])[n:5][c:6]([N:10]2[CH2:11][CH2:12][c:13]3[c:14]([cH:17][cH:18][cH:19][cH:20]3)[CH2:15][CH2:16]2)[c:7]1[C:8]#[N:9].[H-:32].[Na+:33].[O:34]1[CH2:35][CH2:36][CH2:37][CH2:38]1.[OH:23][CH2:24][CH2:25][N:26]1[CH2:27][CH2:28][O:29][CH2:30][CH2:31]1>>[c:2]1([O:23][CH2:24][CH2:25][N:26]2[CH2:27][CH2:28][O:29][CH2:30][CH2:31]2)[n:3][c:4]([S:21][CH3:22])[n:5][c:6]([N:10]2[CH2:11][CH2:12][c:13]3[c:14]([cH:17][cH:18][cH:19][cH:20]3)[CH2:15][CH2:16]2)[c:7]1[C:8]#[N:9]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 923Sodium IonHCID 8028TetrahydrofuranHCID 611632-MorpholinoethanolHCID 166653HydrideHCID 220039654-Chloro-2-methylsulfanyl-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile

생성물 1

HCID 220039712-Methylsulfanyl-4-(2-morpholin-4-ylethoxy)-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidine-5-carbonitrile

출처 및 근거

ORD 기록
ord-db94e132c4cd4107b870558bf80ee8b8
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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