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Dimethylformamide → (8-Tert-butyl-1-oxa-2-azaspiro[4.5]dec-2-en-3-yl)-(4-thiazol-2-ylpiperazin-1-yl)methanone

HRID 1552277
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HRID 1552277 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[CH:5]1[CH2:6][CH2:7][C:8]2([CH2:9][C:10]([C:13](=[O:14])[OH:15])=[N:11][O:12]2)[CH2:16][CH2:17]1.[CH3:29][N:30]1[CH2:31][CH2:32][O:33][CH2:34][CH2:35]1.[O:60]=[CH:61][N:62]([CH3:63])[CH3:64].[P-:36]([F:37])([F:38])([F:39])([F:40])([F:41])[F:42].[n:43]1([O:44][C:45]([N:46]([CH3:47])[CH3:48])=[N+:49]([CH3:50])[CH3:51])[c:52]2[cH:53][cH:54][cH:55][cH:56][c:57]2[n:58][n:59]1.[s:18]1[c:19]([N:23]2[CH2:24][CH2:25][NH:26][CH2:27][CH2:28]2)[n:20][cH:21][cH:22]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[CH:5]1[CH2:6][CH2:7][C:8]2([CH2:9][C:10]([C:13](=[O:15])[N:26]3[CH2:25][CH2:24][N:23]([c:19]4[s:18][cH:22][cH:21][n:20]4)[CH2:28][CH2:27]3)=[N:11][O:12]2)[CH2:16][CH2:17]1
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참가 물질

7

반응물 6

HCID 6228DimethylformamideHCID 79724-MethylmorpholineHCID 9886HexafluorophosphateHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 9118061-(Thiazol-2-yl)piperazineHCID 579514498-Tert-butyl-1-oxa-2-azaspiro[4.5]dec-2-ene-3-carboxylic acid

생성물 1

HCID 11976295
(8-Tert-butyl-1-oxa-2-azaspiro[4.5]dec-2-en-3-yl)-(4-thiazol-2-ylpiperazin-1-yl)methanone

출처 및 근거

ORD 기록
ord-df0cf7f15f47407db4a6ddfb76a7c32e
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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