Pyridine → 5-Chloro-N-{1-[(3-cyanophenyl)methyl]-4-fluoro-1H-indazol-3-yl}-2-thiophenesulfonamide

반응식

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

참가 물질

반응물 3

HCID 1049Pyridine

HCID 27339255-Chlorothiophene-2-sulfonyl chloride

HCID 580543733-[(3-Amino-4-fluoro-1H-indazol-1-yl)methyl]benzonitrile

생성물 1

HCID 580545775-Chloro-N-{1-[(3-cyanophenyl)methyl]-4-fluoro-1H-indazol-3-yl}-2-thiophenesulfonamide

출처 및 근거

ORD 기록: ord-a5b3b10aaa2f4da5af3c9ccb9cee7847
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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