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Benzene → tetrahydro-1-(5-t-butyl-1,3,4-thiadiazol-2-yl)-3-methyl-6-propynoyloxy-2(1H)-pyrimidinone

HRID 104232
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HRID 104232 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][n:7][c:8]([N:10]2[C:11](=[O:18])[N:12]([CH3:17])[CH2:13][CH2:14][CH:15]2[OH:16])[s:9]1.[C:26]([C:27]#[CH:28])(=[O:29])[Cl:30].[CH3:19][CH2:20][N:21]([CH2:22][CH3:23])[CH2:24][CH3:25].[cH:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][n:7][c:8]([N:10]2[C:11](=[O:18])[N:12]([CH3:17])[CH2:13][CH2:14][CH:15]2[O:16][C:26]([C:27]#[CH:28])=[O:29])[s:9]1
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반응물 4

HCID 241BenzeneHCID 8471TriethylamineHCID 122606682-Propynoyl chlorideHCID 21400082tetrahydro-1-(5-t-butyl-1,3,4-thiadiazol-2-yl)-3-methyl-6-hydroxy-2(1H)-pyrimidinone

생성물 1

HCID 21455427tetrahydro-1-(5-t-butyl-1,3,4-thiadiazol-2-yl)-3-methyl-6-propynoyloxy-2(1H)-pyrimidinone

출처 및 근거

ORD 기록
ord-59ca113e97a84008bd3197bfdbc40e9a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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