5-Fluoro-2-methylbenzenesulphonyl chloride → N-{3-[5-(2-Amino-4-pyrimidinyl)-2-(1,1-dimethylethyl)-1,3-thiazol-4-yl]-2-fluorophenyl}-5-fluoro-2-methylbenzenesulfonamide

HRID 2156036Notes

Reaction equation

HRID 2156036 reaction equation
[CH3:58][c:59]1[c:60]([S:66](=[O:67])(=[O:68])[Cl:69])[cH:61][c:62]([F:65])[cH:63][cH:64]1.[Cl:1][c:2]1[n:3][c:4](-[c:5]2[s:6][c:7]([CH:8]([CH3:9])[CH3:10])[n:11][c:12]2-[c:13]2[cH:14][c:15]([NH:16][S:17]([c:18]3[c:19]([F:20])[cH:21][cH:22][cH:23][c:24]3[F:25])(=[O:26])=[O:27])[cH:28][cH:29][cH:30]2)[cH:31][cH:32][n:33]1.[NH2:34][c:35]1[c:36]([F:57])[c:37](-[c:41]2[n:42][c:43]([C:53]([CH3:54])([CH3:55])[CH3:56])[s:44][c:45]2-[c:46]2[n:47][c:48]([NH2:52])[n:49][cH:50][cH:51]2)[cH:38][cH:39][cH:40]1>>[NH:34]([c:35]1[c:36]([F:57])[c:37](-[c:41]2[n:42][c:43]([C:53]([CH3:54])([CH3:55])[CH3:56])[s:44][c:45]2-[c:46]2[n:47][c:48]([NH2:52])[n:49][cH:50][cH:51]2)[cH:38][cH:39][cH:40]1)[S:66]([c:60]1[c:59]([CH3:58])[cH:64][cH:63][c:62]([F:65])[cH:61]1)(=[O:67])=[O:68]

Participants

4

Reactant 3

HCID 1362865-Fluoro-2-methylbenzenesulphonyl chlorideHCID 579897094-[4-(3-Amino-2-fluorophenyl)-2-(1,1-dimethylethyl)-1,3-thiazol-5-yl]-2-pyrimidinamineHCID 57990030N-{3-[5-(2-chloro-4-pyrimidinyl)-2-(1-methylethyl)-1,3-thiazol-4-yl]phenyl}-2,6-difluorobenzenesulfonamide

Product 1

HCID 57989896N-{3-[5-(2-Amino-4-pyrimidinyl)-2-(1,1-dimethylethyl)-1,3-thiazol-4-yl]-2-fluorophenyl}-5-fluoro-2-methylbenzenesulfonamide

Sources & evidence

ORD record
ord-a1f3f28696ae4ba89d754735650d819c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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