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

반응식

[Br:25][c:26]1[c:27]([F:37])[cH:28][c:29]([F:36])[c:30]([S:32](=[O:33])(=[O:34])[NH2:35])[cH:31]1.[CH:1]1([c:4]2[cH:5][c:6](-[c:15]3[cH:16][cH:17][c:18]([C:21]([F:22])([F:23])[F:24])[cH:19][cH:20]3)[n:7][c:8]3[n:9]2[n:10][cH:11][c:12]3[C:13]#[CH:14])[CH2:2][CH2:3]1>>[CH:1]1([c:4]2[cH:5][c:6](-[c:15]3[cH:16][cH:17][c:18]([C:21]([F:22])([F:23])[F:24])[cH:19][cH:20]3)[n:7][c:8]3[n:9]2[n:10][cH:11][c:12]3[C:13]#[C:14][c:26]2[c:27]([F:37])[cH:28][c:29]([F:36])[c:30]([S:32](=[O:33])(=[O:34])[NH2:35])[cH:31]2)[CH2:2][CH2:3]1

참가 물질

반응물 2

HCID 27732955-Bromo-2,4-difluorobenzenesulfonamide

HCID 866080497-Cyclopropyl-3-ethynyl-5-(4-trifluoromethyl-phenyl)-pyrazolo[1,5-a]pyrimidine

생성물 1

HCID 118515195-[7-Cyclopropyl-5-(4-trifluoromethyl-phenyl)-pyrazolo[1,5-a]pyrimidin-3-ylethynyl]-2,4-difluoro-benzenesulfonamide

출처 및 근거

ORD 기록: ord-fbc87d9c57224857950e7f7bf53cba01
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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