2-(Pyrrolidin-1-ylmethyl)pyrrolidine → [4-(3-Methylsulfonylpropoxy)phenyl]-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone

반응식

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

참가 물질

반응물 2

HCID 1428252-(Pyrrolidin-1-ylmethyl)pyrrolidine

HCID 597867704-(3-Methanesulfonyl-propoxy)-benzoic acid methyl ester

생성물 1

HCID 11959834[4-(3-Methylsulfonylpropoxy)phenyl]-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone

출처 및 근거

ORD 기록: ord-6d7ce1fb68c74290b2acbe4b888d3bee
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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