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Hydrochloric Acid → N-(trans-4-methylcyclohexyl)benzothiazole-2-carboxamide

HRID 105537
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HRID 105537 반응식
[C:13]([n:14]1[cH:15][cH:16][n:17][cH:18]1)([n:19]1[cH:20][cH:21][n:22][cH:23]1)=[O:24].[CH3:26][CH:27]1[CH2:28][CH2:29][CH:30]([NH2:33])[CH2:31][CH2:32]1.[CH3:44][N:45]([CH3:46])[CH:47]=[O:48].[CH:34]([N:35]([CH2:36][CH3:37])[CH:38]([CH3:39])[CH3:40])([CH3:41])[CH3:42].[ClH:25].[ClH:43].[s:1]1[c:2]([C:10](=[O:11])[OH:12])[n:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2>>[s:1]1[c:2]([C:10](=[O:12])[NH:33][CH:30]2[CH2:29][CH2:28][CH:27]([CH3:26])[CH2:32][CH2:31]2)[n:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2
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반응물 6

HCID 313Hydrochloric Acid2회HCID 6228DimethylformamideHCID 682631,1'-CarbonyldiimidazoleHCID 806044-MethylcyclohexylamineHCID 81531DiisopropylethylamineHCID 5850531,3-Benzothiazole-2-carboxylic acid

생성물 1

HCID 18462544N-(trans-4-methylcyclohexyl)benzothiazole-2-carboxamide

출처 및 근거

ORD 기록
ord-bd9bd0e5d1914b9583eb0238a60973de
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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