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Dimethyl Sulfoxide → 7-[3-(Dimethylamino)pyrrolidin-1-yl]-5-methyl-6-phenyl-2-pyrazin-2-yl-1,3-benzoxazole-4-carbonitrile

HRID 110880
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인쇄 미리보기

반응식

HRID 110880 반응식
[CH3:1][N:2]([CH:3]1[CH2:4][NH:5][CH2:6][CH2:7]1)[CH3:8].[CH3:41][S:42](=[O:43])[CH3:44].[CH3:9][CH2:10][N:11]([CH2:12][CH3:13])[CH2:14][CH3:15].[F:16][c:17]1[c:18](-[c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[c:19]([CH3:34])[c:20]([C:32]#[N:33])[c:21]2[n:22][c:23](-[c:26]3[n:27][cH:28][cH:29][n:30][cH:31]3)[o:24][c:25]12>>[CH3:1][N:2]([CH:3]1[CH2:4][N:5]([c:17]2[c:18](-[c:35]3[cH:36][cH:37][cH:38][cH:39][cH:40]3)[c:19]([CH3:34])[c:20]([C:32]#[N:33])[c:21]3[n:22][c:23](-[c:26]4[n:27][cH:28][cH:29][n:30][cH:31]4)[o:24][c:25]23)[CH2:6][CH2:7]1)[CH3:8]
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 679Dimethyl SulfoxideHCID 8471TriethylamineHCID 27585193-(Dimethylamino)pyrrolidineHCID 685858077-Fluoro-5-methyl-6-phenyl-2-(pyrazin-2-yl)-1,3-benzoxazole-4-carbonitrile

생성물 1

HCID 775264037-[3-(Dimethylamino)pyrrolidin-1-yl]-5-methyl-6-phenyl-2-pyrazin-2-yl-1,3-benzoxazole-4-carbonitrile

출처 및 근거

ORD 기록
ord-17947a8ee24b4dd89cbb0bfc70fcba1a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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