Sodium ion → Ethyl 3-{[5-(3-methyl-5-{[4-(trifluoromethyl)pyrimidin-2-yl]amino}phenyl)-1,3-thiazol-2-yl]methyl}-2-oxopyrrolidine-3-carboxylate

HRID 1115124Notes

Reaction equation

HRID 1115124 reaction equation
[Br:14][CH2:15][c:16]1[s:17][c:18](-[c:21]2[cH:22][c:23]([NH:28][c:29]3[n:30][cH:31][cH:32][c:33]([C:35]([F:36])([F:37])[F:38])[n:34]3)[cH:24][c:25]([CH3:27])[cH:26]2)[cH:19][n:20]1.[CH3:44][CH2:45][O:46][C:47](=[O:48])[CH3:49].[H-:1].[Na+:2].[O:39]1[CH2:40][CH2:41][CH2:42][CH2:43]1.[O:3]=[C:4]1[NH:5][CH2:6][CH2:7][CH:8]1[C:9](=[O:10])[O:11][CH2:12][CH3:13]>>[O:3]=[C:4]1[NH:5][CH2:6][CH2:7][C:8]1([C:9](=[O:10])[O:11][CH2:12][CH3:13])[CH2:15][c:16]1[s:17][c:18](-[c:21]2[cH:22][c:23]([NH:28][c:29]3[n:30][cH:31][cH:32][c:33]([C:35]([F:36])([F:37])[F:38])[n:34]3)[cH:24][c:25]([CH3:27])[cH:26]2)[cH:19][n:20]1

Participants

7

Reactant 6

HCID 923Sodium ionHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 166653HydrideHCID 12699000Ethyl 2-oxopyrrolidine-3-carboxylateHCID 58456292N-{3-[2-(bromomethyl)-1,3-thiazol-5-yl]-5-methylphenyl}-4-(trifluoromethyl)pyrimidin-2-amine

Product 1

HCID 58456303Ethyl 3-{[5-(3-methyl-5-{[4-(trifluoromethyl)pyrimidin-2-yl]amino}phenyl)-1,3-thiazol-2-yl]methyl}-2-oxopyrrolidine-3-carboxylate

Sources & evidence

ORD record
ord-61685a3694154fc1bb60b08e2d4f3ad9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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