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Hydrochloric Acid → 2-Chloro-N-(1-hydroxy-cycloheptylmethyl)-5-(2-methyl-thiazol-4-yl)-benzamide

HRID 1560651
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HRID 1560651 반응식
[CH3:38][N:39]([CH3:40])[CH2:41][CH2:42][CH2:43][N:44]=[C:45]=[N:46][CH2:47][CH3:48].[CH3:49][CH2:50][N:51]([CH2:52][CH3:53])[CH2:54][CH3:55].[CH3:56][N:57]([CH3:58])[CH:59]=[O:60].[CH3:61][CH2:62][O:63][C:64](=[O:65])[CH3:66].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][c:8](-[c:11]2[n:12][c:13]([CH3:16])[s:14][cH:15]2)[cH:9][cH:10]1.[ClH:37].[NH2:17][CH2:18][C:19]1([OH:26])[CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25]1.[OH:27][n:28]1[c:29]2[cH:30][cH:31][cH:32][cH:33][c:34]2[n:35][n:36]1>>[Cl:1][c:2]1[c:3]([C:4](=[O:6])[NH:17][CH2:18][C:19]2([OH:26])[CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25]2)[cH:7][c:8](-[c:11]2[n:12][c:13]([CH3:16])[s:14][cH:15]2)[cH:9][cH:10]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 184386481-(Aminomethyl)cycloheptan-1-ol
HCID 18438656
2-Chloro-5-(2-methyl-1,3-thiazol-4-yl)benzoic acid

생성물 1

HCID 566620342-Chloro-N-(1-hydroxy-cycloheptylmethyl)-5-(2-methyl-thiazol-4-yl)-benzamide

출처 및 근거

ORD 기록
ord-1f8b930ef43243108d4a5826c2b0123f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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