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Water → 6-Fluoro-pyridine-2-carboxylic acid (6-chloro-4-propyl-pyridazin-3-ylmethyl)-isobutyl-amide

HRID 295292
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반응식

HRID 295292 반응식
[CH3:27][CH2:28][N:29]=[C:30]=[N:31][CH2:32][CH2:33][CH2:34][N:35]([CH3:36])[CH3:37].[CH3:42][N:43]([c:44]1[cH:45][cH:46][n:47][cH:48][cH:49]1)[CH3:50].[Cl:1][c:2]1[cH:3][c:4]([CH2:14][CH2:15][CH3:16])[c:5]([CH2:8][NH:9][CH2:10][CH:11]([CH3:12])[CH3:13])[n:6][n:7]1.[Cl:39][CH2:40][Cl:41].[F:17][c:18]1[cH:19][cH:20][cH:21][c:22]([C:24](=[O:25])[OH:26])[n:23]1.[OH2:38]>>[Cl:1][c:2]1[cH:3][c:4]([CH2:14][CH2:15][CH3:16])[c:5]([CH2:8][N:9]([CH2:10][CH:11]([CH3:12])[CH3:13])[C:24]([c:22]2[cH:21][cH:20][cH:19][c:18]([F:17])[n:23]2)=[O:25])[n:6][n:7]1
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참가 물질

7

반응물 6

HCID 962WaterHCID 6344DichloromethaneHCID 142844-(Dimethylamino)pyridineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 2260276-Fluoropyridine-2-carboxylic acidHCID 58661541(6-Chloro-4-propyl-pyridazin-3-ylmethyl)-isobutyl-amine

생성물 1

HCID 58661540
6-Fluoro-pyridine-2-carboxylic acid (6-chloro-4-propyl-pyridazin-3-ylmethyl)-isobutyl-amide

출처 및 근거

ORD 기록
ord-b648e67b7f214c5ea85e082fa5b46f89
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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