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Hydrochloric Acid → 1-methyl-2-[2-(5-phenyl-[1,2,4]oxadiazol-3-yl)-morpholin-4-yl]-1H-[4,4']bipyrimidinyl-6-one

HRID 1536171
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HRID 1536171 반응식
[CH3:19][n:20]1[c:21]([N:33]2[CH2:34][CH2:35][O:36][CH:37]([c:38]3[o:39][n:40][c:41](-[c:42]4[cH:43][cH:44][cH:45][cH:46][cH:47]4)[n:48]3)[CH2:49]2)[n:22][c:23](-[c:27]2[n:28][cH:29][n:30][cH:31][cH:32]2)[cH:24][c:25]1=[O:26].[CH3:50][CH2:51][N:52]([CH2:53][CH3:54])[CH2:55][CH3:56].[ClH:1].[O:57]1[CH2:58][CH2:59][CH2:60][CH2:61]1.[c:2]1(-[c:8]2[n:9][c:10]([CH:13]3[O:14][CH2:15][CH2:16][NH:17][CH2:18]3)[n:11][o:12]2)[cH:3][cH:4][cH:5][cH:6][cH:7]1>>[c:2]1(-[c:8]2[n:9][c:10]([CH:13]3[O:14][CH2:15][CH2:16][N:17]([c:21]4[n:20]([CH3:19])[c:25](=[O:26])[cH:24][c:23](-[c:27]5[n:28][cH:29][n:30][cH:31][cH:32]5)[n:22]4)[CH2:18]3)[n:11][o:12]2)[cH:3][cH:4][cH:5][cH:6][cH:7]1
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참가 물질

6

반응물 5

HCID 313Hydrochloric AcidHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 577987881-methyl-2-(2-(3-phenyl-[1,2,4]oxadiazol-5-yl)-morpholin-4-yl)-1H-[4,4']bipyrimidinyl-6-oneHCID 580978912-(5-Phenyl-1,2,4-oxadiazol-3-yl)morpholine

생성물 1

HCID 57798787
1-methyl-2-[2-(5-phenyl-[1,2,4]oxadiazol-3-yl)-morpholin-4-yl]-1H-[4,4']bipyrimidinyl-6-one

출처 및 근거

ORD 기록
ord-d7992f1ee34e4a37817a71937a76f280
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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