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Sodium Ion → 4-Tert-butyl-2-{5-[3-(3-cyano-6-methylindole-1-yl)propyl]-benzofuran-2-yl}thiazole

HRID 2314878
노트
인쇄 미리보기

반응식

HRID 2314878 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][c:7](-[c:10]2[o:11][c:12]3[c:13]([cH:14]2)[cH:15][c:16]([CH2:19][CH2:20][CH2:21][Cl:22])[cH:17][cH:18]3)[s:8][cH:9]1.[C:23](#[N:24])[c:25]1[cH:26][nH:27][c:28]2[cH:29][c:30]([CH3:34])[cH:31][cH:32][c:33]12.[Na+:36].[O:37]1[CH2:38][CH2:39][CH2:40][CH2:41]1.[OH-:35]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][c:7](-[c:10]2[o:11][c:12]3[c:13]([cH:14]2)[cH:15][c:16]([CH2:19][CH2:20][CH2:21][n:27]2[cH:26][c:25]([C:23]#[N:24])[c:33]4[c:28]2[cH:29][c:30]([CH3:34])[cH:31][cH:32]4)[cH:17][cH:18]3)[s:8][cH:9]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 923Sodium IonHCID 961HydroxideHCID 8028TetrahydrofuranHCID 196037484-Tert-butyl-2-[5-(3-chloropropyl)benzofuran-2-yl]thiazoleHCID 196038046-Methyl-1H-indole-3-carbonitrile

생성물 1

HCID 196036914-Tert-butyl-2-{5-[3-(3-cyano-6-methylindole-1-yl)propyl]-benzofuran-2-yl}thiazole

출처 및 근거

ORD 기록
ord-cafbaa2680ad4b2ebc61bd5ad5dcef12
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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