Pyridine → tetrahydro-1-(5-trifluoromethyl-1,3,4-thiadiazol-2-yl)-3-methyl-6-phenoxycarbonyloxy-2(1H)-pyrimidinone

반응식

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

참가 물질

반응물 3

HCID 1049Pyridine

HCID 15891Phenyl chloroformate

HCID 21400101tetrahydro-1-(5-trifluoromethyl-1,3,4-thiadiazol-2-yl)-3-methyl-6-hydroxy-2(1H)-pyrimidinone

생성물 1

HCID 21418648tetrahydro-1-(5-trifluoromethyl-1,3,4-thiadiazol-2-yl)-3-methyl-6-phenoxycarbonyloxy-2(1H)-pyrimidinone

출처 및 근거

ORD 기록: ord-dc33f3383ec1417aa5b0fa3a80ff25d5
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

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