5-Bromo-2,4-difluorobenzenesulfonamide → 5-[5-(4-Chloro-3-methyl-phenyl)-7-difluoromethyl-pyrazolo[1,5-a]pyrimidin-3-ylethynyl]-2,4-difluoro-benzenesulfonamide

반응식

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

참가 물질

반응물 2

HCID 27732955-Bromo-2,4-difluorobenzenesulfonamide

HCID 866080845-(4-Chloro-3-methyl-phenyl)-7-difluoromethyl-3-ethynyl-pyrazolo[1,5-a]pyrimidine

생성물 1

HCID 118526205-[5-(4-Chloro-3-methyl-phenyl)-7-difluoromethyl-pyrazolo[1,5-a]pyrimidin-3-ylethynyl]-2,4-difluoro-benzenesulfonamide

출처 및 근거

ORD 기록: ord-daba4d2762b14ea9bdf7c7e4e9dc828c
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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