2-Methylpyrrolidine → (R)-4-(2-(2-(2-Methylpyrrolidin-1-yl)-ethyl)benzofuran-5-yl)benzonitrile

반응식

[CH3:1][S:2]([O:3][CH2:6][CH2:7][c:8]1[o:9][c:10]2[c:11]([cH:12]1)[cH:13][c:14](-[c:17]1[cH:18][cH:19][c:20]([C:23]#[N:24])[cH:21][cH:22]1)[cH:15][cH:16]2)(=[O:4])=[O:5].[CH3:25][CH:26]1[NH:27][CH2:28][CH2:29][CH2:30]1>>[CH2:6]([CH2:7][c:8]1[o:9][c:10]2[c:11]([cH:12]1)[cH:13][c:14](-[c:17]1[cH:18][cH:19][c:20]([C:23]#[N:24])[cH:21][cH:22]1)[cH:15][cH:16]2)[N:27]1[CH:26]([CH3:25])[CH2:30][CH2:29][CH2:28]1

참가 물질

반응물 2

HCID 130032-Methylpyrrolidine

HCID 113936782-[5-(4-cyanophenyl)-1-benzofuran-2-yl]ethyl Methanesulfonate

생성물 1

HCID 9883980(R)-4-(2-(2-(2-Methylpyrrolidin-1-yl)-ethyl)benzofuran-5-yl)benzonitrile

출처 및 근거

ORD 기록: ord-758d9ade96ab4dacb69d130b7f66d639
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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