Acetate → Isopropyl 4-({6-[5-(methylsulfonyl)indolin-1-yl]pyrimidin-4-yl}oxy)piperidine-1-carboxylate

HRID 125890

Reaction equation

HRID 125890 reaction equation
[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][c:7]2[c:11]([cH:12][cH:13]1)[NH:10][CH2:9][CH2:8]2.[CH3:34][C:35]([CH3:36])([O-:37])[CH3:38].[Cl:14][c:15]1[cH:16][c:17]([O:21][CH:22]2[CH2:23][CH2:24][N:25]([C:28](=[O:29])[O:30][CH:31]([CH3:32])[CH3:33])[CH2:26][CH2:27]2)[n:18][cH:19][n:20]1.[Na+:39].[O-:47][C:48]([CH3:49])=[O:50].[O-:51][C:52]([CH3:53])=[O:54].[O:41]1[CH2:42][CH2:43][CH2:44][CH2:45]1.[OH2:40].[Pd+2:46]>>[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][c:7]2[c:11]([cH:12][cH:13]1)[N:10]([c:15]1[cH:16][c:17]([O:21][CH:22]3[CH2:23][CH2:24][N:25]([C:28](=[O:29])[O:30][CH:31]([CH3:32])[CH3:33])[CH2:26][CH2:27]3)[n:18][cH:19][n:20]1)[CH2:9][CH2:8]2

Participants

9

Reactant 8

HCID 175Acetate2×HCID 923Sodium ionHCID 962WaterHCID 8028TetrahydrofuranHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 27361365-(Methanesulfonyl)-2,3-dihydro-1H-indoleHCID 45749132-Methylpropan-2-olateHCID 467382884-(6-Chloro-pyrimidin-4-yloxy)-piperidine-1-carboxylic acid isopropyl ester

Product 1

HCID 25260830Isopropyl 4-({6-[5-(methylsulfonyl)indolin-1-yl]pyrimidin-4-yl}oxy)piperidine-1-carboxylate

Sources & evidence

ORD record
ord-cb5b491215da47b79e54f208df3b99e3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

Loading…