Propargylamine → 3-(3,4-Dichlorophenyl)-N-(2-propynyl)azetidine carboxamide

반응식

[C:30]([c:31]1[cH:32][cH:33][c:34]([CH:35]2[CH2:36][N:37]([C:38]([NH:39][CH2:40][CH:41]=[CH2:42])=[O:45])[CH2:43]2)[cH:44][cH:46]1)([CH3:47])([CH3:48])[CH3:49].[CH2:26]([C:27]#[CH:28])[NH2:29].[Cl:1][c:2]1[cH:3][c:4]([CH:9]2[CH2:10][N:11]([CH:13]([c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)[c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[CH2:12]2)[cH:5][cH:6][c:7]1[Cl:8]>>[Cl:1][c:2]1[cH:3][c:4]([CH:9]2[CH2:10][N:11]([C:13]([NH:29][CH2:26][C:27]#[CH:28])=[O:45])[CH2:12]2)[cH:5][cH:6][c:7]1[Cl:8]

참가 물질

반응물 3

HCID 239041Propargylamine

HCID 226054023-(3,4-Dichlorophenyl)-1-(diphenylmethyl)azetidine

HCID 226054033-(4-tert-butylphenyl)-N-(2-propenyl)azetidine-1-carboxamide

생성물 1

HCID 226054203-(3,4-Dichlorophenyl)-N-(2-propynyl)azetidine carboxamide

출처 및 근거

ORD 기록: ord-2b969cd5cf904c1ab2b6e90bb0bacc44
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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