Dimethyl Sulfoxide → N-[4-(2-chlorophenyl)-6-[2-(hydroxymethyl)pyrrolidin-1-yl]-3-pyridinyl]-2-(3,5-dichlorophenyl)-N,2-dimethylpropanamide

반응식

[CH3:37][S:38](=[O:39])[CH3:40].[Cl:1][c:2]1[cH:3][c:4](-[c:23]2[c:24]([Cl:29])[cH:25][cH:26][cH:27][cH:28]2)[c:5]([N:8]([C:9]([C:10]([CH3:11])([CH3:12])[c:13]2[cH:14][c:15]([Cl:20])[cH:16][c:17]([Cl:19])[cH:18]2)=[O:21])[CH3:22])[cH:6][n:7]1.[NH:30]1[CH:31]([CH2:32][OH:33])[CH2:34][CH2:35][CH2:36]1>>[c:2]1([N:30]2[CH:31]([CH2:32][OH:33])[CH2:34][CH2:35][CH2:36]2)[cH:3][c:4](-[c:23]2[c:24]([Cl:29])[cH:25][cH:26][cH:27][cH:28]2)[c:5]([N:8]([C:9]([C:10]([CH3:11])([CH3:12])[c:13]2[cH:14][c:15]([Cl:20])[cH:16][c:17]([Cl:19])[cH:18]2)=[O:21])[CH3:22])[cH:6][n:7]1

참가 물질

반응물 3

HCID 679Dimethyl Sulfoxide

HCID 90908Prolinol

HCID 86597667HCID 86597667, 화합물

생성물 1

HCID 11353102N-[4-(2-chlorophenyl)-6-[2-(hydroxymethyl)pyrrolidin-1-yl]-3-pyridinyl]-2-(3,5-dichlorophenyl)-N,2-dimethylpropanamide

출처 및 근거

ORD 기록: ord-57355cb09dc4420792a2044c514469d9
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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