Acetonitrile → Methyl 2-(4-methoxy-6-trifluoromethoxy-2-pyrimidinylaminocarbonylaminosulfonyl)benzoate

HRID 116802

반응식

HRID 116802 반응식
[CH3:1][O:2][C:3](=[O:4])[c:5]1[c:6]([S:11](=[O:12])(=[O:13])[N:14]=[C:15]=[O:16])[cH:7][cH:8][cH:9][cH:10]1.[CH3:31][C:32]#[N:33].[NH2:17][c:18]1[n:19][c:20]([O:26][C:27]([F:28])([F:29])[F:30])[cH:21][c:22]([O:24][CH3:25])[n:23]1>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[c:6]([S:11](=[O:12])(=[O:13])[NH:14][C:15](=[O:16])[NH:17][c:18]2[n:19][c:20]([O:26][C:27]([F:28])([F:29])[F:30])[cH:21][c:22]([O:24][CH3:25])[n:23]2)[cH:7][cH:8][cH:9][cH:10]1

참가 물질

4

반응물 3

HCID 6342AcetonitrileHCID 156281Benzoic acid, 2-(isocyanatosulfonyl)-, methyl esterHCID 150227204-Methoxy-6-(trifluoromethoxy)pyrimidin-2-amine

생성물 1

HCID 15022726Methyl 2-(4-methoxy-6-trifluoromethoxy-2-pyrimidinylaminocarbonylaminosulfonyl)benzoate

출처 및 근거

ORD 기록
ord-797ab6cff5b4474eab181149ac63b0b8
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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