Dimethylformamide → {2-[2-cyclopentyl-1-(4-methanesulfonyl-phenyl)-ethyl]-1H-pyrrolo[2,3-b]pyridin-5-yl}-acetonitrile

반응식

[CH3:32][N:33]([CH3:34])[CH:35]=[O:36].[Cl:1][CH2:2][c:3]1[cH:4][c:5]2[c:6]([n:7][cH:8]1)[nH:9][c:10]([CH:12]([CH2:13][CH:14]1[CH2:15][CH2:16][CH2:17][CH2:18]1)[c:19]1[cH:20][cH:21][c:22]([S:25](=[O:26])(=[O:27])[CH3:28])[cH:23][cH:24]1)[cH:11]2.[Na:29][C:30]#[N:31]>>[CH2:2]([c:3]1[cH:4][c:5]2[c:6]([n:7][cH:8]1)[nH:9][c:10]([CH:12]([CH2:13][CH:14]1[CH2:15][CH2:16][CH2:17][CH2:18]1)[c:19]1[cH:20][cH:21][c:22]([S:25](=[O:26])(=[O:27])[CH3:28])[cH:23][cH:24]1)[cH:11]2)[C:30]#[N:31]

참가 물질

반응물 3

HCID 6228Dimethylformamide

HCID 672294355-chloromethyl-2-[2-cyclopentyl-1-(4-methanesulfonyl-phenyl)-ethyl]-1H-pyrrolo[2,3-b]pyridine

HCID 178511850HCID 178511850, 화합물

생성물 1

HCID 53251082{2-[2-cyclopentyl-1-(4-methanesulfonyl-phenyl)-ethyl]-1H-pyrrolo[2,3-b]pyridin-5-yl}-acetonitrile

출처 및 근거

ORD 기록: ord-c696c3c487094792ac605505317d3bbe
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

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