2-Amino-1-butanol → 5-Cyano-1-(3-trifluoromethoxybenzyl)-1H-indole-2-carboxylic acid (1-hydroxymethylpropyl)amide

반응식

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

참가 물질

반응물 2

HCID 221292-Amino-1-butanol

HCID 685431065-cyano-1-(3-trifluoromethoxybenzyl)-1H-indole-2-carboxylic acid

생성물 1

HCID 592054145-Cyano-1-(3-trifluoromethoxybenzyl)-1H-indole-2-carboxylic acid (1-hydroxymethylpropyl)amide

출처 및 근거

ORD 기록: ord-25d34e8d21b04563ac85a9af119ee1a6
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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