Ethanol → Tert-butyl 4-(4-(5-acetyl-4-chloro-6-(2-(isopropylsulfonyl)phenylamino)pyrimidin-2-ylamino)-5-isopropoxy-2-methylphenyl)piperidine-1-carboxylate

HRID 701402Notes

Reaction equation

HRID 701402 reaction equation
[C:25]([CH3:26])([CH3:27])([CH3:28])[O:29][C:30](=[O:31])[N:32]1[CH2:33][CH2:34][CH:35]([c:38]2[c:39]([CH3:49])[cH:40][c:41]([NH2:48])[c:42]([O:44][CH:45]([CH3:46])[CH3:47])[cH:43]2)[CH2:36][CH2:37]1.[CH3:50][CH2:51][OH:52].[Cl:1][c:2]1[n:3][c:4]([NH:12][c:13]2[c:14]([S:19](=[O:20])(=[O:21])[CH:22]([CH3:23])[CH3:24])[cH:15][cH:16][cH:17][cH:18]2)[c:5]([C:9]([CH3:10])=[O:11])[c:6]([Cl:8])[n:7]1>>[c:2]1([NH:48][c:41]2[cH:40][c:39]([CH3:49])[c:38]([CH:35]3[CH2:34][CH2:33][N:32]([C:30]([O:29][C:25]([CH3:26])([CH3:27])[CH3:28])=[O:31])[CH2:37][CH2:36]3)[cH:43][c:42]2[O:44][CH:45]([CH3:46])[CH3:47])[n:3][c:4]([NH:12][c:13]2[c:14]([S:19](=[O:20])(=[O:21])[CH:22]([CH3:23])[CH3:24])[cH:15][cH:16][cH:17][cH:18]2)[c:5]([C:9]([CH3:10])=[O:11])[c:6]([Cl:8])[n:7]1

Participants

4

Reactant 3

HCID 702EthanolHCID 582908761-(2,4-Dichloro-6-(2-(isopropylsulfonyl)phenylamino)pyrimidin-5-yl)ethanoneHCID 597645801,1-Dimethylethyl 4-[4-amino-2-methyl-5-(1-methylethoxy)phenyl]-1-piperidinecarboxylate

Product 1

HCID 58290910Tert-butyl 4-(4-(5-acetyl-4-chloro-6-(2-(isopropylsulfonyl)phenylamino)pyrimidin-2-ylamino)-5-isopropoxy-2-methylphenyl)piperidine-1-carboxylate

Sources & evidence

ORD record
ord-ba9f4a00cb274a9da481bbfd786c7246
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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