M-Phenylenediamine → N-[[3-[4-[4-(3-aminoanilino)-4-cyanopiperidin-1-yl]-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

HRID 94305

반응식

HRID 94305 반응식
[NH2:29][c:30]1[cH:31][c:32]([NH2:33])[cH:34][cH:35][cH:36]1.[Na:26][C:27]#[N:28].[O:1]=[C:2]1[CH2:3][CH2:4][N:5]([c:8]2[c:9]([F:25])[cH:10][c:11]([N:14]3[C:15](=[O:24])[O:16][CH:17]([CH2:19][NH:20][C:21]([CH3:22])=[O:23])[CH2:18]3)[cH:12][cH:13]2)[CH2:6][CH2:7]1>>[C:2]1([C:27]#[N:28])([NH:33][c:32]2[cH:31][c:30]([NH2:29])[cH:36][cH:35][cH:34]2)[CH2:3][CH2:4][N:5]([c:8]2[c:9]([F:25])[cH:10][c:11]([N:14]3[C:15](=[O:24])[O:16][CH:17]([CH2:19][NH:20][C:21]([CH3:22])=[O:23])[CH2:18]3)[cH:12][cH:13]2)[CH2:6][CH2:7]1

참가 물질

4

반응물 3

HCID 7935M-PhenylenediamineHCID 19599390HCID 19599390, 화합물HCID 178511850HCID 178511850, 화합물

생성물 1

HCID 68702733N-[[3-[4-[4-(3-aminoanilino)-4-cyanopiperidin-1-yl]-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

출처 및 근거

ORD 기록
ord-9cd2e03b39dc454982523f0ed4b42188
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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