Pyridine → 4-{5-[(2-Phenyl-5-trifluoromethyl-oxazole-4-carbonyl)-amino]-pyrimidin-2-yl}-piperazine-1-carboxylic acid tert-butyl ester

HRID 1122068Notes

Reaction equation

HRID 1122068 reaction equation
[C:30]([CH3:31])([CH3:32])([CH3:33])[O:34][C:35](=[O:36])[N:37]1[CH2:38][CH2:39][N:40]([c:43]2[n:44][cH:45][c:46]([NH2:49])[cH:47][n:48]2)[CH2:41][CH2:42]1.[CH2:50]([Cl:51])[Cl:52].[CH3:25][N:26]([CH3:27])[CH:28]=[O:29].[Cl:19][C:20]([C:21]([Cl:22])=[O:23])=[O:24].[c:1]1(-[c:7]2[o:8][c:9]([C:15]([F:16])([F:17])[F:18])[c:10]([C:12](=[O:13])[OH:14])[n:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[cH:53]1[cH:54][cH:55][n:56][cH:57][cH:58]1>>[c:1]1(-[c:7]2[o:8][c:9]([C:15]([F:16])([F:17])[F:18])[c:10]([C:12](=[O:14])[NH:49][c:46]3[cH:45][n:44][c:43]([N:40]4[CH2:39][CH2:38][N:37]([C:35]([O:34][C:30]([CH3:31])([CH3:32])[CH3:33])=[O:36])[CH2:42][CH2:41]4)[n:48][cH:47]3)[n:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

7

Reactant 6

HCID 1049PyridineHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 65578Oxalyl chlorideHCID 27764382-Phenyl-5-(trifluoromethyl)-oxazole-4-carboxylic acidHCID 594643191,1-Dimethylethyl 4-(5-amino-2-pyrimidinyl)-1-piperazinecarboxylate

Product 1

HCID 667384454-{5-[(2-Phenyl-5-trifluoromethyl-oxazole-4-carbonyl)-amino]-pyrimidin-2-yl}-piperazine-1-carboxylic acid tert-butyl ester

Sources & evidence

ORD record
ord-753d99991a764a49b368579b3906b558
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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