1-Pyrrolidineethanamine → 2-(3-(4-fluorobenzyl)-2-oxoimidazolidin-1-yl)-4-methyl-N-(2-(pyrrolidin-1-yl)ethyl)thiazole-5-carboxamide

반응식

[F:17][c:18]1[cH:19][cH:20][c:21]([CH2:22][N:23]2[C:24](=[O:37])[N:25]([c:28]3[s:29][c:30]([C:34](=[O:35])[OH:36])[c:31]([CH3:33])[n:32]3)[CH2:26][CH2:27]2)[cH:38][cH:39]1.[NH2:1][CH2:2][c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1.[NH2:9][CH2:10][CH2:11][N:12]1[CH2:13][CH2:14][CH2:15][CH2:16]1>>[NH:9]([CH2:10][CH2:11][N:12]1[CH2:13][CH2:14][CH2:15][CH2:16]1)[C:34]([c:30]1[s:29][c:28]([N:25]2[C:24](=[O:37])[N:23]([CH2:22][c:21]3[cH:20][cH:19][c:18]([F:17])[cH:39][cH:38]3)[CH2:27][CH2:26]2)[n:32][c:31]1[CH3:33])=[O:35]

참가 물질

반응물 3

HCID 13441-Pyrrolidineethanamine

HCID 7504Benzylamine

HCID 579197992-(3-(4-Fluorobenzyl)-2-oxoimidazolidin-1-yl)-4-methylthiazole-5-carboxylic acid

생성물 1

HCID 594812812-(3-(4-fluorobenzyl)-2-oxoimidazolidin-1-yl)-4-methyl-N-(2-(pyrrolidin-1-yl)ethyl)thiazole-5-carboxamide

출처 및 근거

ORD 기록: ord-6f36370da7de4c64a16020c45050a6d5
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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